SCHEMBL12816144

SCHEMBL12816144

Cc1c(-c2ccccc2)cc([Si](Cl)(c2cc(-c3ccccc3)c(C)c(-c3ccccc3)c2)c2cc(-c3ccccc3)c(C)c(-c3ccccc3)c2)cc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 1/20 0.44
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 3/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
PTGS1 P23219 1/20 0.39
AKT1 P31749 1/20 0.38
AKT2 P31751 1/20 0.38
ESR2 Q92731 1/20 0.38
BACE1 P56817 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 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
SCHEMBL12815367 0.92 SQOR (0.42) SQORKDM4EALDH1A1MAPTRAB9A
SCHEMBL12815489 0.81 ESR2 (0.38) SQORKDM4EALDH1A1MAPTRAB9A
SCHEMBL12816430 0.81 BACE1 (0.39) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL20180021 0.81 SQOR (0.46) SQORKDM4EALDH1A1MAPTRAB9A
SCHEMBL12815897 0.80 ESR2 (0.40) SQORKDM4EALDH1A1MAPTRAB9A
SCHEMBL12816561 0.79 SQOR (0.44) SQORKDM4EALDH1A1MAPTRAB9A
SCHEMBL12816348 0.77 MEN1 (0.37) KDM4EALDH1A1MAPTRAB9AMEN1
SCHEMBL12816012 0.77 MEN1 (0.37) KDM4EALDH1A1MAPTRAB9AMEN1
SCHEMBL12816186 0.76 SQOR (0.42) SQORKDM4EALDH1A1MAPTRAB9A
SCHEMBL12816811 0.76 ESR2 (0.53) SQORAKT1AKT2ESR2BACE1

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