SCHEMBL21733660

SCHEMBL21733660

CCOC(=O)C1CC(C)C(c2nc(N(Cc3ccc(OC)cc3)Cc3ccc(OC)cc3)cc(C)c2C(F)(F)F)CC1=O

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.31
KMT2A Q03164 2/20 0.31
PDE2A O00408 1/20 0.30
TP53 P04637 1/20 0.30
FABP4 P15090 1/20 0.30
ALDH1A1 P00352 3/20 0.30
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
MEN1 O00255 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GAA P10253 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
POLB P06746 1/20 0.30
LMNA P02545 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL21733469 0.93 HCRTR2 (0.31) HCRTR2LTB4R2KMT2APDE2ATP53
SCHEMBL21733931 0.90 PDE2A (0.33) LTB4R2PDE2AFABP4
SCHEMBL28490711 0.88 TUBB3 (0.33) KMT2ATP53ALDH1A1MEN1KDM4E
SCHEMBL21733844 0.87 POLB (0.33) HCRTR2KMT2APDE2ATP53ALDH1A1
SCHEMBL21733858 0.87 PDE10A (0.33) KMT2ATP53ALDH1A1USP2TSHR
SCHEMBL21733861 0.86 ALDH1A1 (0.33) LTB4R2KMT2APDE2ATP53ALDH1A1
SCHEMBL26268266 0.83 TP53 (0.32) HCRTR2LTB4R2TP53ALDH1A1USP2
SCHEMBL21733838 0.83 TP53 (0.32) HCRTR2LTB4R2TP53ALDH1A1USP2
SCHEMBL24854893 0.81 KDM4E (0.32) KMT2AALDH1A1MEN1KDM4EGAA
SCHEMBL21733785 0.80 KMT2A (0.32) KMT2APDE2AFABP4ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4547666-A1 METHODS FOR TREATMENT OF CANCER Frontier Medicines Corporation (US) 2025-05-07 EP disclosed
US-20250129103-A1 METHODS FOR TREATMENT OF CANCER FRONTIER MEDICINES CORPORATION 2025-04-24 US disclosed
EP-4476220-A1 METHODS FOR TREATMENT OF CANCER Frontier Medicines Corporation (US) 2024-12-18 EP disclosed
CN-112119075-B Condensed ring compound 豪夫迈·罗氏有限公司 2024-03-12 CN disclosed
WO-2024006445-A1 METHODS FOR TREATMENT OF CANCER FRONTIER MEDICINES CORPORATION (US) 2024-01-04 WO disclosed
US-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
US-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
WO-2023150394-A1 METHODS FOR TREATMENT OF CANCER FRONTIER MEDICINES CORPORATION (US) 2023-08-10 WO disclosed
WO-2023150394-A1 METHODS FOR TREATMENT OF CANCER FRONTIER MEDICINES CORPORATION (US) 2023-08-10 WO disclosed
CN-112119075-A Fused ring compound 豪夫迈·罗氏有限公司 2020-12-22 CN disclosed
WO-2020035031-A1 FUSED RING COMPOUNDS GENENTECH, INC. (US) 2020-02-20 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 (2 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-11760744-B2 Fused ring compounds KRAS, NRAS, HRAS HCRTR2 4007/4885LTB4R2 3402/4885KMT2A 3557/4885
US-20250129103-A1 METHODS FOR TREATMENT OF CANCER KRAS, HRAS, TP53 HCRTR2 4674/4885LTB4R2 3328/4885KMT2A 1397/4885

“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.