SCHEMBL4059192

SCHEMBL4059192

Cc1ccc(Nc2ccc(NC(=O)c3ccccc3F)cn2)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.60
RAB9A P51151 5/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 1/20 0.60
TP53 P04637 1/20 0.60
GLA P06280 1/20 0.60
GAA P10253 1/20 0.60
HSD17B10 Q99714 1/20 0.60
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
P4HTM Q9NXG6 1/20 0.56
POLB P06746 1/20 0.50
LMNA P02545 1/20 0.49
TDP1 Q9NUW8 2/20 0.49
ABL1 P00519 1/20 0.48
MAPT P10636 1/20 0.47
PKM P14618 1/20 0.47
DHODH Q02127 3/20 0.47
GRM4 Q14833 1/20 0.47

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
SCHEMBL4059473 0.90 BLK (0.52) NPC1RAB9ASMN1; SMN2TP53HSD17B10
SCHEMBL4063410 0.87 RAB9A (0.56) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL4065422 0.82 HPGD (0.50) NPC1RAB9AKDM4EALDH1A1KMT2A
SCHEMBL4068987 0.80 P4HTM (0.58) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL4064006 0.79 HPGD (0.47) RAB9AKMT2AMEN1POLBABL1
SCHEMBL4058628 0.79 RAB9A (0.61) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL4061179 0.79 NPC1 (0.56) NPC1RAB9ASMN1; SMN2TP53HSD17B10
SCHEMBL13581604 0.74 MEN1 (0.83) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL4061634 0.72 KMT2A (0.51) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL12262601 0.71 RAB9A (0.74) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1028945-B9 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2009-02-18 EP claimed
EP-1028945-B1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2007-07-11 EP claimed
US-20020035094-A1 Substituted pyridine compounds and methods of use AMGEN INC. 2002-03-21 US claimed
EP-1028945-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS Amgen Inc. (US) 2000-08-23 EP claimed
US-6022884-A PROPHYLAXIS OR TREATMENT OF INFLAMMATION AMGEN INC. (US) 2000-02-08 US claimed
WO-1999024404-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC. (US) 1999-05-20 WO claimed
EP-1028945-B9 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2009-02-18 EP disclosed
EP-1028945-B1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2007-07-11 EP disclosed
US-6458813-B1 2-CYCLOHEXYLOXY-5-(2-CHLOROPHENYLCARBONYLAMINO)PYRIDINE, FOR EXAMPLE; TREATING INFLAMMATION, PAIN, DIABETES, CANCER AMGEN INC. 2002-10-01 US disclosed
US-20020035094-A1 Substituted pyridine compounds and methods of use AMGEN INC. 2002-03-21 US disclosed
US-6333341-B1 TUMOR NECROSIS FACTOR, ANTIINFLAMMATORY AGENTS AND ANALGESICS AMGEN INC. 2001-12-25 US disclosed
US-6184237-B1 Substituted pyridine compounds and methods of use AMGEN INC. 2001-02-06 US disclosed
US-6022884-A PROPHYLAXIS OR TREATMENT OF INFLAMMATION AMGEN INC. (US) 2000-02-08 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 (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-20020035094-A1 Substituted pyridine compounds and methods of use IL1B, IL6, IL1A NPC1 2800/4885RAB9A 2767/4885SMN1; SMN2 2578/4885

“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.