SCHEMBL7301385

SCHEMBL7301385

Cc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.69
RAB9A P51151 3/20 0.69
KMT2A Q03164 3/20 0.69
NR1H4 Q96RI1 3/20 0.68
LMNA P02545 1/20 0.68
MAPT P10636 1/20 0.68
MAPK1 P28482 1/20 0.68
ATM Q13315 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
HDAC3 O15379 2/20 0.64
HDAC6 Q9UBN7 2/20 0.64
HDAC11 Q96DB2 1/20 0.64
HDAC8 Q9BY41 1/20 0.64
KCNK9 Q9NPC2 1/20 0.63
TRPV1 Q8NER1 4/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
TP53 P04637 1/20 0.62
THRB P10828 1/20 0.62
FKBP5 Q13451 1/20 0.61
KCNK3 O14649 1/20 0.61

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
SCHEMBL21588673 0.92 HDAC6 (0.67) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL25721410 0.92 HDAC6 (0.67) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL12652028 0.89 RAB9A (0.68) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL7295519 0.86 NPC1 (0.66) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL2350394 0.86 ALDH1A1 (0.59) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL823156 0.84 RAB9A (0.75) NPC1RAB9AKMT2AMAPTTDP1
SCHEMBL7303163 0.84 HDAC3 (0.86) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL7295360 0.84 NR1H4 (0.60) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL15652616 0.84 NPC1 (0.61) NPC1RAB9AKMT2ANR1H4LMNA
SCHEMBL7295404 0.84 NR1H4 (0.67) NPC1RAB9AKMT2ANR1H4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476430-B2 Fused heterocyclic compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2013-07-02 US disclosed
US-20110124640-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2011-05-26 US disclosed
WO-2010011837-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-01-28 WO disclosed
EP-0358118-B1 Phenylamides - process for their preparation as well as a drug containing those compounds BOEHRINGER MANNHEIM GMBH (DE) 1994-03-16 EP disclosed
US-5135949-A Anticoagulants BOEHRINGER MANNHEIM GMBH (DE) 1992-08-04 US disclosed
EP-0358118-A1 Phenylamides - process for their preparation as well as a drug containing those compounds Roche Diagnostics GmbH (DE) 1990-03-14 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 (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-20110124640-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BTK, LYN, ABL1 NPC1 4412/4885RAB9A 744/4885KMT2A 715/4885

“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.