SCHEMBL20535296

SCHEMBL20535296

O=C(NC1CCC1)c1cc2ccc(Br)cc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MLLT1 Q03111 1/20 0.57
DRD4 P21917 1/20 0.56
SMYD3 Q9H7B4 2/20 0.48
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
HRH4 Q9H3N8 1/20 0.48
RET P07949 1/20 0.46
KDR P35968 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43

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
SCHEMBL29176327 0.97 MLLT1 (0.61) MLLT1DRD4SMYD3RAB9ANPC1
SCHEMBL29176357 0.96 MLLT1 (0.60) MLLT1DRD4SMYD3RAB9ANPC1
SCHEMBL18183271 0.96 MLLT1 (0.60) MLLT1DRD4SMYD3RAB9ANPC1
SCHEMBL20534668 0.94 DRD4 (0.58) MLLT1DRD4SMYD3RAB9AHRH4
SCHEMBL3612493 0.88 DRD4 (0.50) MLLT1DRD4HRH4
SCHEMBL3612490 0.88 DRD4 (0.50) MLLT1DRD4HRH4
SCHEMBL3599033 0.85 DRD4 (0.52) MLLT1DRD4SMYD3HRH4KDR
SCHEMBL3599029 0.85 DRD4 (0.52) MLLT1DRD4SMYD3HRH4KDR
SCHEMBL3599027 0.85 DRD4 (0.52) MLLT1DRD4SMYD3HRH4KDR
SCHEMBL1613614 0.83 MLLT1 (0.64) MLLT1SMYD3RAB9AHRH4MEN1

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115785100-B Compounds useful as RET inhibitors 癌症研究科技有限公司 2025-01-07 CN claimed
US-20250243202-A1 Compounds Useful as RET Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2025-07-31 US disclosed
CN-115785100-B Compounds useful as RET inhibitors 癌症研究科技有限公司 2025-01-07 CN disclosed
US-20240132504-A1 Compounds Useful as RET Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-04-25 US disclosed
US-11680068-B2 Compounds useful as RET inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-06-20 US disclosed
US-11680068-B2 Compounds useful as RET inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-06-20 US disclosed
US-11680068-B2 Compounds useful as RET inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-06-20 US disclosed
CN-115785100-A Compounds useful as RET inhibitors 癌症研究科技有限公司 2023-03-14 CN disclosed
EP-4105219-A1 PYRAZOLOPYRIMIDINE COMPOUNDS USEFUL AS RET INHIBITORS Cancer Research Technology Limited (GB) 2022-12-21 EP disclosed
EP-4105219-A1 PYRAZOLOPYRIMIDINE COMPOUNDS USEFUL AS RET INHIBITORS Cancer Research Technology Limited (GB) 2022-12-21 EP disclosed
US-20220348585-A1 Compounds Useful as RET Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-11-03 US disclosed
CN-110506043-B Compounds useful as RET inhibitors 癌症研究科技有限公司 2022-11-01 CN disclosed
US-11352361-B2 Compounds useful as RET inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-06-07 US disclosed
US-11352361-B2 Compounds useful as RET inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-06-07 US disclosed
EP-3609898-B1 COMPOUNDS USEFUL AS RET INHIBITORS CANCER RESEARCH TECH LTD (GB) 2022-06-01 EP disclosed
EP-3609898-B1 COMPOUNDS USEFUL AS RET INHIBITORS CANCER RESEARCH TECH LTD (GB) 2022-06-01 EP disclosed
US-20200157107-A1 Compounds Useful as RET Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2020-05-21 US disclosed
US-20200157107-A1 Compounds Useful as RET Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2020-05-21 US disclosed
EP-3609898-A1 COMPOUNDS USEFUL AS RET INHIBITORS Cancer Research Technology Limited (GB) 2020-02-19 EP disclosed
WO-2018189553-A1 COMPOUNDS USEFUL AS RET INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-10-18 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 (6 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-20250243202-A1 Compounds Useful as RET Inhibitors RET, BCR, REL MLLT1 102/4885DRD4 1570/4885SMYD3 1164/4885
US-20220348585-A1 Compounds Useful as RET Inhibitors RET, BCR, REL MLLT1 102/4885DRD4 1570/4885SMYD3 1164/4885
US-11352361-B2 Compounds useful as RET inhibitors RET, BCR, REL MLLT1 102/4885DRD4 1570/4885SMYD3 1164/4885
US-20200157107-A1 Compounds Useful as RET Inhibitors RET, BCR, REL MLLT1 102/4885DRD4 1570/4885SMYD3 1164/4885
US-20240132504-A1 Compounds Useful as RET Inhibitors RET, BCR, REL MLLT1 102/4885DRD4 1570/4885SMYD3 1164/4885
US-11680068-B2 Compounds useful as RET inhibitors RET, BCR, REL MLLT1 102/4885DRD4 1570/4885SMYD3 1164/4885

“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.