SCHEMBL8566067

SCHEMBL8566067

Cc1cc(C(F)(F)F)ccc1CC(N)=O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.54
RXRB P28702 2/20 0.54
RXRG P48443 1/20 0.54
DAO P14920 1/20 0.44
ICMT O60725 5/20 0.44
POLQ O75417 3/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.41
CFTR P13569 1/20 0.41
AGBL2 Q5U5Z8 1/20 0.41
NR1H4 Q96RI1 1/20 0.40
CES2 O00748 1/20 0.40

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
SCHEMBL17899450 0.84 RXRA (0.72) RXRARXRBRXRGDAOPOLQ
SCHEMBL14060046 0.84 RXRA (0.55) RXRARXRBRXRGDAOPOLQ
SCHEMBL12226966 0.83 DAO (0.49) RXRARXRBRXRGDAOKDM4E
SCHEMBL16401777 0.83 IDO1 (0.54) DAOICMTPOLQKDM4EALDH1A1
SCHEMBL14562998 0.83 POLQ (0.56) DAOICMTPOLQALDH1A1CES2
SCHEMBL31434924 0.83 IDO1 (0.54) DAOICMTPOLQKDM4EALDH1A1
SCHEMBL7472612 0.82 CES2 (0.44) RXRARXRBRXRGICMTPOLQ
SCHEMBL31434971 0.81 DAO (0.46) DAOICMTALDH1A1
SCHEMBL21541013 0.81 ANO1 (0.51) ICMTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9890740 0.81 PTGDR2 (0.46) ICMTPOLQPTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360118-A1 Bicyclic Compounds and their Uses NOVARTIS PHARMA AG (CH) 2024-10-31 US disclosed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US disclosed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US disclosed
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US 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-20070161677-A1 Bisarylurea derivatives BRAF, RAF1, NRAS RXRA 1619/4885RXRB 1471/4885RXRG 1761/4885
US-20240360118-A1 Bicyclic Compounds and their Uses H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C1R, F12 RXRA 1596/4885RXRB 2116/4885RXRG 1832/4885

“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.