SCHEMBL4655418

SCHEMBL4655418

COc1ccc(-c2ccccc2Cn2cc(Cc3cc(C)cc(C)c3)c3cc(C(=N)N)ccc32)c(C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.49
TP53 P04637 3/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MCL1 Q07820 1/20 0.42
BAD Q92934 1/20 0.42
ICMT O60725 2/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
F2 P00734 3/20 0.40
PRSS1 P07477 1/20 0.40
F10 P00742 1/20 0.39
PLG P00747 1/20 0.39
F7 P08709 1/20 0.39
F3 P13726 1/20 0.39
CHRM1 P11229 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
POLB P06746 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
SCHEMBL4627926 0.94 PLA2G2A (0.54) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL4658466 0.90 PLA2G2A (0.51) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL4626941 0.90 PLA2G2A (0.55) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL4658955 0.89 PLA2G2A (0.51) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL5899891 0.87 PLA2G2A (0.52) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL4656156 0.87 PLA2G2A (0.51) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL5899822 0.86 PLA2G2A (0.51) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL4657840 0.85 TP53 (0.45) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL4657990 0.85 PLA2G2A (0.49) PLA2G2ATP53MAPTSMN1; SMN2LMNA
SCHEMBL4658570 0.84 PLA2G2A (0.49) PLA2G2ATP53MAPTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1633716-A4 BIARYLMETHYL INDOLINES, INDOLES AND TETRAHYDROQUINOLINES, USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2008-03-26 EP claimed
US-7129264-B2 Biarylmethyl indolines and indoles as antithromboembolic agents BRISTOL-MYERS SQUIBB COMPANY (US) 2006-10-31 US claimed
EP-1633716-A2 BIARYLMETHYL INDOLINES, INDOLES AND TETRAHYDROQUINOLINES, USEFUL AS SERINE PROTEASE INHIBITORS Bristol-Myers Squibb Company (US) 2006-03-15 EP claimed
WO-2004094372-A2 COMPOUNDS USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-11-04 WO claimed
US-20040220206-A1 Biarylmethyl indolines, indoles and tetrahydroquinolines, useful as serine protease inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-11-04 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20040220206-A1 Biarylmethyl indolines, indoles and tetrahydroquinolines, useful as serine protease inhibitors TFPI, TFPI2, F2 PLA2G2A 1334/4885TP53 3506/4885MAPT 3408/4885

“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.