SCHEMBL25223545

SCHEMBL25223545

COc1cccc(C(=O)c2cc(Br)ccc2N)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.63
POLB P06746 1/20 0.63
PARP1 P09874 1/20 0.54
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
STS P08842 2/20 0.52
NPC1 O15118 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
CYP2C8 P10632 1/20 0.50
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
LMNA P02545 2/20 0.48
PKM P14618 1/20 0.48
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
HPGD P15428 1/20 0.46
FPR1 P21462 1/20 0.46
FPR2 P25090 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25653103 0.86 CES2 (0.53) MAPTPARP1CES2CES1STS
SCHEMBL8588323 0.85 MAPT (0.70) MAPTPOLBNPC1MAPK1HTT
SCHEMBL4680433 0.84 CYP2C8 (0.59) MAPTPOLBPARP1CES2CES1
SCHEMBL4675271 0.84 CYP2C8 (0.59) MAPTPOLBPARP1CES2CES1
SCHEMBL4267213 0.84 GAA (0.59) MAPTPARP1CES2CES1STS
SCHEMBL2702939 0.83 RAB9A (0.56) MAPTPOLBPARP1CES2CES1
SCHEMBL29379915 0.82 MAPT (0.66) MAPTPOLBNPC1MAPK1HTT
SCHEMBL14740763 0.82 MAPT (0.66) MAPTPOLBNPC1MAPK1HTT
SCHEMBL5188852 0.82 MAPT (0.55) MAPTPOLBNPC1MAPK1HTT
SCHEMBL30136061 0.82 CES2 (0.62) MAPTPARP1CES2CES1STS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260125390-A1 SOLID FORMS OF MACROCYCLIC COMPOUNDS, SALTS AND FORMULATIONS THEREOF, AND METHODS OF PREPARING AND USING THE SAME KURA ONCOLOGY INC (US) 2026-05-07 US disclosed
EP-4720073-A1 SOLID FORMS OF A MACROCYCLIC FARNESYLTRANSFERASE INHIBITOR AND FORMULATIONS THEREOF, AND METHODS OF PREPARING AND USING THE MACROCYCLIC COMPOUND AND ITS SOLID FORMS Kura Oncology, Inc. (US) 2026-04-08 EP disclosed
EP-4698173-A1 TREATMENT OF NON-SMALL CELL LUNG CANCER WITH A COMBINATION OF 3-AMINO-3-(1-METHYL-1H-IMIDAZOL-5-YL)-6-OXA-2(4,6)-QUINOLINA-1,4(1,3)-DIBENZENACYCLOHEXAPHANE-22,44-DICARBONITRILE AND AN EGFR-TKI Kura Oncology, Inc. (US) 2026-02-25 EP disclosed
US-12466835-B1 Solid forms of macrocyclic compounds, salts and formulations thereof, and methods of preparing and using the same KURA ONCOLOGY, INC. (US) 2025-11-11 US disclosed
EP-4637769-A1 METHODS OF TREATING ADVANCED SOLID TUMORS Kura Oncology, Inc. (US) 2025-10-29 EP disclosed
CN-119504706-A Macrocyclic compounds having farnesyl transferase inhibitory activity 库拉肿瘤学公司 2025-02-25 CN disclosed
WO-2024245364-A1 SOLID FORMS OF A MACROCYCLIC FARNESYLTRANSFERASE INHIBITOR AND FORMULATIONS THEREOF, AND METHODS OF PREPARING AND USING THE MACROCYCLIC COMPOUND AND ITS SOLID FORMS KURA ONCOLOGY, INC. (US) 2024-12-05 WO disclosed
WO-2024220600-A1 TREATMENT OF NON-SMALL CELL LUNG CANCER WITH A COMBINATION OF 3-AMINO-3-(1-METHYL-1H-IMIDAZOL-5-YL)-6-OXA-2(4,6)-QUINOLINA-1,4(1,3)-DIBENZENACYCLOHEXAPHANE-22,44-DICARBONITRILE AND AN EGFR-TKI KURA ONCOLOGY, INC. (US) 2024-10-24 WO disclosed
EP-4441038-A1 MACROCYCLIC COMPOUNDS HAVING FARNESYLTRANSFERASE INHIBITORY ACTIVITY Kura Oncology, Inc. (US) 2024-10-09 EP disclosed
US-20240287023-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME KURA ONCOLOGY INC (US) 2024-08-29 US disclosed
WO-2024137751-A1 METHODS OF TREATING ADVANCED SOLID TUMORS KURA ONCOLOGY, INC. (US) 2024-06-27 WO disclosed
WO-2024137751-A1 METHODS OF TREATING ADVANCED SOLID TUMORS KURA ONCOLOGY, INC. (US) 2024-06-27 WO disclosed
US-12018011-B2 Macrocyclic compounds and compositions, and methods of preparing and using the same KURA ONCOLOGY, INC. (US) 2024-06-25 US disclosed
US-12018011-B2 Macrocyclic compounds and compositions, and methods of preparing and using the same KURA ONCOLOGY, INC. (US) 2024-06-25 US disclosed
US-12018011-B2 Macrocyclic compounds and compositions, and methods of preparing and using the same KURA ONCOLOGY, INC. (US) 2024-06-25 US disclosed
US-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME WUXI APPTEC (HONG KONG) LIMITED (CN) 2023-10-12 US disclosed
US-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME WUXI APPTEC (HONG KONG) LIMITED (CN) 2023-10-12 US disclosed
US-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME WUXI APPTEC (HONG KONG) LIMITED (CN) 2023-10-12 US disclosed
WO-2023102378-A1 MACROCYCLIC COMPOUNDS HAVING FARNESYLTRANSFERASE INHIBITORY ACTIVITY KURA ONCOLOGY, INC. (US) 2023-06-08 WO disclosed
WO-2023102378-A1 MACROCYCLIC COMPOUNDS HAVING FARNESYLTRANSFERASE INHIBITORY ACTIVITY KURA ONCOLOGY, INC. (US) 2023-06-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260125390-A1 SOLID FORMS OF MACROCYCLIC COMPOUNDS, SALTS AND FORMULATIONS THEREOF, AND METHODS OF PREPARING AND USING THE SAME FDPS, PCTP, MTTP MAPT 2019/4885POLB 4699/4885PARP1 4681/4885
US-12466835-B1 Solid forms of macrocyclic compounds, salts and formulations thereof, and methods of preparing and using the same FNTA, SF3B1, SF3A1 MAPT 2911/4885POLB 4681/4885PARP1 3827/4885
US-12018011-B2 Macrocyclic compounds and compositions, and methods of preparing and using the same FNTA, FDPS, GGPS1 MAPT 4146/4885POLB 4533/4885PARP1 3715/4885
US-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME FNTA, FDPS, GGPS1 MAPT 4146/4885POLB 4533/4885PARP1 3715/4885
US-20240287023-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME FNTA, FDPS, GGPS1 MAPT 4146/4885POLB 4533/4885PARP1 3715/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.