SCHEMBL14875014

SCHEMBL14875014

Cc1ccc(C=[N+]([O-])c2ccc(C3=NCCS3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
NPC1 O15118 3/20 0.36
RAB9A P51151 2/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
ALDH1A1 P00352 6/20 0.35
MAPT P10636 6/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
G6PD P11413 2/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
RECQL P46063 1/20 0.34
MGLL Q99685 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL14874985 0.86 LMNA (0.50) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL14875025 0.86 G6PD (0.49) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL14875038 0.86 RAB9A (0.46) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL14874969 0.80 SMN1; SMN2 (0.44) SMN1; SMN2LMNANPC1RAB9ANFKB1
SCHEMBL9329758 0.80 MAPT (0.45) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL11404254 0.76 ALDH1A1 (0.53) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL14874901 0.74 MAPT (0.35) NPC1RAB9AALDH1A1MAPTHPGD
SCHEMBL14777410 0.72 ALDH1A1 (0.54) NPC1RAB9AALDH1A1MAPTHPGD
SCHEMBL14777411 0.72 ALDH1A1 (0.54) NPC1RAB9AALDH1A1MAPTHPGD
SCHEMBL5610907 0.69 PDPK1 (0.41) NPC1RAB9AALDH1A1MAPTHPGD

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
CN-105367509-A Polymer-filler coupling additives BRIDGESTONE CORP 2016-03-02 CN claimed
EP-1802593-B1 POLYMER-FILLER COUPLING ADDITIVES BRIDGESTONE CORP (JP) 2013-04-24 EP claimed
CN-105367509-A Polymer-filler coupling additives BRIDGESTONE CORP 2016-03-02 CN disclosed
CN-101084202-B Polymer-Filler Coupling Additives BRIDGESTONE CO.,LTD. (JP) 2015-11-25 CN disclosed
EP-1802593-B1 POLYMER-FILLER COUPLING ADDITIVES BRIDGESTONE CORP (JP) 2013-04-24 EP disclosed