SCHEMBL23625504

SCHEMBL23625504

Cc1ccc(-n2c3ccccc3c3ccc(C#N)cc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.44
KDM4E B2RXH2 2/20 0.44
ATM Q13315 1/20 0.44
ALDH1A1 P00352 2/20 0.43
CYP2A6 P11509 1/20 0.43
USP14 P54578 5/20 0.42
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 2/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
RECQL P46063 1/20 0.39
CASP7 P55210 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP2 O95551 3/20 0.38
TP53 P04637 1/20 0.37
PTGER4 P35408 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL22148669 0.92 ALDH1A1 (0.50) ALDH1A1CYP2A6USP14LMNAMAPT
SCHEMBL23625549 0.91 USP14 (0.48) L3MBTL1KDM4EATMALDH1A1CYP2A6
SCHEMBL16807020 0.88 KDM4E (0.60) L3MBTL1KDM4EATMUSP14TDP2
SCHEMBL23625548 0.86 USP14 (0.51) ALDH1A1CYP2A6USP14LMNATDP2
SCHEMBL18907178 0.86 L3MBTL1 (0.42) L3MBTL1KDM4EATMALDH1A1CYP2A6
SCHEMBL23625507 0.86 ALDH1A1 (0.43) L3MBTL1KDM4EATMALDH1A1LMNA
SCHEMBL17565589 0.85 USP14 (0.45) L3MBTL1KDM4EATMALDH1A1CYP2A6
SCHEMBL23625555 0.85 KDM4E (0.44) L3MBTL1KDM4EATMUSP14TDP2
SCHEMBL17032719 0.85 KDM4E (0.43) L3MBTL1KDM4EATMUSP14TDP2
SCHEMBL24617064 0.85 KIF11 (0.44) L3MBTL1KDM4EATMUSP14PTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021135516-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2021-07-08 WO disclosed