SCHEMBL10882007

SCHEMBL10882007

CC(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.63
HDAC4 P56524 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
FFAR2 O15552 1/20 0.46
ADRB2 P07550 1/20 0.44
POLB P06746 2/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
CNR1 P21554 2/20 0.42
S1PR1 P21453 1/20 0.42
S1PR3 Q99500 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
GABBR2 O75899 3/20 0.41
GABBR1 Q9UBS5 3/20 0.41
TSHR P16473 3/20 0.41
LMNA P02545 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL28419252 0.92 BRD4 (0.55) BRD4HDAC4HDAC7HDAC5POLB
SCHEMBL2302536 0.90 BRD4 (0.53) BRD4HDAC4HDAC7HDAC5FFAR2
SCHEMBL28837739 0.88 CYP19A1 (0.57) BRD4HDAC4HDAC7HDAC5FFAR2
SCHEMBL2303082 0.87 CYP1A2 (0.54) BRD4HDAC4HDAC7HDAC5CNR1
SCHEMBL2302103 0.87 HPGD (0.58) BRD4HDAC4HDAC7HDAC5MEN1
SCHEMBL17504249 0.85 BRD4 (0.49) BRD4HDAC4HDAC7HDAC5CNR1
SCHEMBL2303105 0.82 UGT2B7 (0.47) BRD4HDAC4HDAC7HDAC5MEN1
SCHEMBL4440986 0.82 BRD4 (0.46) BRD4HDAC4HDAC7HDAC5FFAR2
SCHEMBL4431837 0.81 BRD4 (0.49) BRD4HDAC4HDAC7HDAC5POLB
SCHEMBL2302648 0.81 HDAC4 (0.51) BRD4HDAC4HDAC7HDAC5CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0097864-B1 PHOTOPOLYMERIZABLE MIXTURE AND PHOTOPOLYMERIZABLE COPYING MATERIAL PRODUCED THEREWITH HOECHST AKTIENGESELLSCHAFT (DE) 1986-11-12 EP disclosed
US-4530747-A Terminal (meth)acrylic ester groups HOECHST AKTIENGESELLSCHAFT (DE) 1985-07-23 US disclosed
EP-0097864-A1 Photopolymerizable mixture and photopolymerizable copying material produced therewith HOECHST AKTIENGESELLSCHAFT (DE) 1984-01-11 EP disclosed