SCHEMBL29073258

SCHEMBL29073258

CC(C)(C)c1ccc(-c2nc3c4cc(-c5ccncc5)ccc4c4ccc(-c5ccncc5)cc4c3n2-c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.47
PIK3CA P42336 3/20 0.39
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
MTOR P42345 2/20 0.39
PIK3CG P48736 2/20 0.39
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
MAPK1 P28482 1/20 0.36
ESR1 P03372 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
SCHEMBL24567380 0.95 KIF11 (0.42) KIF11PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL24567379 0.93 KIF11 (0.47) KIF11PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL29737365 0.93 KIF11 (0.47) KIF11PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL24567378 0.93 KIF11 (0.47) KIF11PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL29073285 0.93 KIF11 (0.47) KIF11PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL29737338 0.93 KIF11 (0.47) KIF11PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL24566496 0.84 PIK3CA (0.39) PIK3CAPIK3CDPIK3CBMTORPIK3CG
SCHEMBL29737328 0.83 OPRD1 (0.37) ALDH1A1HPGDHSD17B10MAPTNPSR1
SCHEMBL29073240 0.83 OPRD1 (0.37) ALDH1A1HPGDHSD17B10MAPTNPSR1
SCHEMBL24567330 0.82 KIF11 (0.38) KIF11ALDH1A1HPGDRECQLHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116783168-A Electrochromic compounds and optical articles comprising the same 依视路国际公司 2023-09-19 CN disclosed
WO-2022136020-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2022-06-30 WO disclosed