SCHEMBL7922966

SCHEMBL7922966

CCc1sc(-c2ccc(N)nc2)nc1-c1ccc(NC(=O)c2cccc(F)c2C)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SCN9A Q15858 5/20 0.39
SCN5A Q14524 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
ABL1 P00519 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
PDPK1 O15530 1/20 0.36
PIK3C2A O00443 1/20 0.36
PIK3C2B O00750 1/20 0.36
RPS6KA4 O75676 1/20 0.36
CYP3A4 P08684 1/20 0.36
PI4KB Q9UBF8 1/20 0.36

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
SCHEMBL7923309 0.91 SMN1; SMN2 (0.43) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL7921586 0.89 KDM4E (0.46) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL7927410 0.85 POLB (0.43) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL7928522 0.77 MEN1 (0.45) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL16472597 0.75 EP300 (0.40) SCN9ASCN5ADYRK1A
SCHEMBL13838396 0.74 GAA (0.34) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL13727778 0.74 ABCB1 (0.35) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL7927414 0.74 SMN1; SMN2 (0.43) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL13838362 0.73 ALDH1A1 (0.38) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL13838407 0.73 NPC1 (0.33) NPC1RAB9ASMN1; SMN2TP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140107132-A1 SUBSTITUTED PYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-04-17 US disclosed
US-20140107132-A1 SUBSTITUTED PYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-04-17 US disclosed
US-20130165451-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2013-06-27 US disclosed
US-8314130-B2 Compounds inclunding substituted pyridines for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-11-20 US disclosed
US-8314130-B2 Compounds inclunding substituted pyridines for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-11-20 US disclosed
US-20120283272-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2012-11-08 US disclosed
US-20100130510-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-05-27 US disclosed
US-20100130510-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-05-27 US disclosed
WO-2010039237-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-04-08 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 (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-20100130510-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 NPC1 199/4885RAB9A 1852/4885SMN1; SMN2 4828/4885
US-20120283272-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 NPC1 199/4885RAB9A 1852/4885SMN1; SMN2 4828/4885
US-20130165451-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 NPC1 199/4885RAB9A 1852/4885SMN1; SMN2 4828/4885
US-20140107132-A1 SUBSTITUTED PYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES NLRP3, NLRP1, NOD1 NPC1 640/4885RAB9A 2084/4885SMN1; SMN2 4784/4885

“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.