SCHEMBL3499310

SCHEMBL3499310

CCOC(=O)c1cn2cc(Br)cc(C)c2n1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.68
KDM4E B2RXH2 2/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
GABRA2 P47869 7/20 0.43
GABRB2 P47870 7/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP1A2 P05177 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
ADORA2A P29274 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL12143979 0.89 RXFP1 (0.52) RXFP1KDM4EPOLBALDH1A1HPGD
Bromide SCHEMBL1366991 0.88 RXFP1 (0.51) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL23534402 0.86 RXFP1 (0.50) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL26664194 0.86 RXFP1 (0.50) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL23534351 0.86 RXFP1 (0.50) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL3698300 0.86 RXFP1 (0.71) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL23534256 0.85 RXFP1 (0.49) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL22438227 0.85 RXFP1 (0.49) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL23535382 0.84 RXFP1 (0.48) RXFP1KDM4EPOLBALDH1A1HPGD
SCHEMBL16705088 0.83 KDM4E (0.51) RXFP1KDM4EPOLBALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111448190-B Substituted indole compounds 百时美施贵宝公司 2023-09-26 CN disclosed
US-11739098-B2 Substituted indole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-29 US disclosed
US-11739098-B2 Substituted indole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-29 US disclosed
US-11739098-B2 Substituted indole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-29 US disclosed
EP-3710440-B1 SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-04-05 EP disclosed
US-20230098244-A1 SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-03-30 US disclosed
US-20210253593-A1 SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-08-19 US disclosed
US-20210253593-A1 SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-08-19 US disclosed
EP-3710440-A1 SUBSTITUTED INDOLE COMPOUNDS Bristol-Myers Squibb Company (US) 2020-09-23 EP disclosed
CN-111448190-A Substituted indole compounds 百时美施贵宝公司 2020-07-24 CN disclosed
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 EP 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 (4 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 RXFP1 90/4885KDM4E 2059/4885POLB 4658/4885
US-20230098244-A1 SUBSTITUTED INDOLE COMPOUNDS TLR7, TLR1, HTR7 RXFP1 337/4885KDM4E 2026/4885POLB 3971/4885
US-20210253593-A1 SUBSTITUTED INDOLE COMPOUNDS TLR7, TLR1, HTR7 RXFP1 337/4885KDM4E 2026/4885POLB 3971/4885
US-11739098-B2 Substituted indole compounds TLR7, TLR1, HTR7 RXFP1 337/4885KDM4E 2026/4885POLB 3971/4885

“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.