SCHEMBL6906723

SCHEMBL6906723

CC(C)c1ccc(CBr)c(-c2cccc3ccccc23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
KIF11 P52732 1/20 0.37
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
GAA P10253 1/20 0.36
ALOX5 P09917 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
HTR7 P34969 1/20 0.34
UGT2B7 P16662 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GPR84 Q9NQS5 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34

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
SCHEMBL3159240 0.80 AKR1C3 (0.51) AKR1C3AKR1C2ALOX5MAPT
SCHEMBL3101185 0.78 CYP1A2 (0.45) GAACYP1A2CYP2D6MAPT
SCHEMBL31517086 0.78 CYP1A2 (0.45) GAACYP1A2CYP2D6MAPT
SCHEMBL28691596 0.78 CRHR1 (0.50) CRHR1AKR1C3AKR1C2KIF11GAA
SCHEMBL22888380 0.78 AKR1C3 (0.48) CRHR1AKR1C3AKR1C2KIF11GAA
SCHEMBL3139862 0.76 METAP2 (0.42) CRHR1AKR1C3AKR1C2KIF11LMNA
SCHEMBL16075900 0.75 AKR1C3 (0.70) CRHR1AKR1C3AKR1C2KIF11GAA
SCHEMBL9179432 0.75 UGT2B7 (0.44) CRHR1AKR1C3AKR1C2KIF11GAA
SCHEMBL27764964 0.72 LMNA (0.44) KIF11GAALMNANPC1MAPT
SCHEMBL6909828 0.70 HPRT1 (0.52) LMNACYP1A2CYP2D6MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6787618-B1 TRANSPARENT, STIFF MOLDING MATERIALS; IMPACT TOUGHNESS; FOOD PACKAGING BASELL POLYPROPYLEN GMBH (DE) 2004-09-07 US disclosed
EP-0776913-B1 High molecular weight copolymers BASELL POLYOLEFINE GMBH (DE) 2004-02-04 EP disclosed
EP-1270614-A2 Copolymers containing propylene and alpha-olefin comonomer Basell Polyolefine GmbH (DE) 2003-01-02 EP disclosed
US-6057408-A CATALYTIC ADDITION COPOLYMERIZATION OF PROPYLENE WITH ETHYLENE OR OLEFIN TARGOR GMBH (DE) 2000-05-02 US disclosed
EP-0776913-A2 High molecular weight copolymers HOECHST AKTIENGESELLSCHAFT (DE) 1997-06-04 EP disclosed