SCHEMBL8675349

SCHEMBL8675349

Cc1ccccc1C1=Cc2ccccc2C1[Zr]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.33
PBRM1 Q86U86 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
NPC1 O15118 1/20 0.33
CASP3 P42574 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
DRD2 P14416 4/20 0.33
DRD4 P21917 4/20 0.33
TSHR P16473 1/20 0.32
ACHE P22303 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL7252931 0.81 CYP1A2 (0.43) SMN1; SMN2TSHRKDM4EALDH1A1
SCHEMBL27450590 0.80 PBRM1 (0.33) RAB9APBRM1TNKS2NPC1CASP3
Hydrochloric Acid SCHEMBL7198818 0.79 TNKS2 (0.32) RAB9APBRM1TNKS2NPC1CASP3
SCHEMBL9067405 0.79 PBRM1 (0.32) RAB9APBRM1TNKS2NPC1CASP3
Hydrochloric Acid SCHEMBL28553655 0.79 GAA (0.33) RAB9APBRM1TNKS2NPC1CASP3
SCHEMBL28351929 0.77 RAB9A (0.31) RAB9APBRM1TNKS2NPC1CASP3
SCHEMBL4566729 0.77 RAB9A (0.38) RAB9APBRM1TNKS2NPC1CASP3
SCHEMBL8073436 0.76 PBRM1 (0.30) RAB9APBRM1TNKS2NPC1CASP3
SCHEMBL8673496 0.76 NPC1 (0.33) RAB9ANPC1SMN1; SMN2TSHRACHE
SCHEMBL8674878 0.73 TACR1 (0.35) TSHRACHELMNA

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
US-5747621-A CATALYTIC ADDITION POLYMERIZATION MONTELL TECHNOLOGY COMPANY BV (NL) 1998-05-05 US disclosed