SCHEMBL12817080

SCHEMBL12817080

Cc1cc(Cc2ccccc2)c([Si](Cl)(c2c(Cc3ccccc3)cc(C)cc2Cc2ccccc2)c2c(Cc3ccccc3)cc(C)cc2Cc2ccccc2)c(Cc2ccccc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.42
BCL2L1 Q07817 1/20 0.42
CYP3A4 P08684 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CALM1 P0DP23 1/20 0.39
IDH1 O75874 2/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
GPR55 Q9Y2T6 1/20 0.38
ALOX5 P09917 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL12816424 0.91 CYP3A4 (0.39) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12816848 0.82 BCL2 (0.40) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12816079 0.81 BCL2 (0.42) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12816472 0.81 PTPN1 (0.41) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12822090 0.81 BCL2 (0.39) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12815404 0.80 CALM1 (0.46) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12816243 0.80 BCL2 (0.38) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12816234 0.79 TSHR (0.43) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12815582 0.78 ADCY10 (0.37) BCL2BCL2L1CYP3A4MEN1KMT2A
SCHEMBL12815950 0.78 ADCY10 (0.37) BCL2BCL2L1CYP3A4MEN1KMT2A

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-2012133935-A1 METHOD FOR PRODUCING THE TRANSITION METAL COMPLEX, CATALYST FOR TRIMERIZATION, METHOD FOR PRODUCING 1-HEXENE, METHOD FOR PRODUCING THE SUBSTITUTED CYCLOPENTADIENE COMPOUND (3) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 WO disclosed