SCHEMBL4355570

SCHEMBL4355570

Cc1cc(-c2cc(C)c(C(=O)Cl)c(C)c2)cc(C)c1C(=O)Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPK1 P28482 1/20 0.39
CYP3A4 P08684 6/20 0.38
TDP1 Q9NUW8 2/20 0.38
POLB P06746 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
ACHE P22303 2/20 0.37
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RXRB P28702 3/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
RXRA P19793 2/20 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
SCHEMBL246394 0.84 TAS1R3 (0.41) ALDH1A1SMN1; SMN2MAPK1POLBTSHR
Phosphine SCHEMBL27814958 0.82 TAS1R3 (0.40) ALDH1A1SMN1; SMN2MAPK1POLBTSHR
SCHEMBL28612978 0.82 TAS1R3 (0.40) ALDH1A1SMN1; SMN2MAPK1POLBTSHR
SCHEMBL2154502 0.82 ALDH1A1 (0.38) CA1CA2ALDH1A1SMN1; SMN2MAPK1
SCHEMBL900744 0.81 CYP3A4 (0.54) CA1CA2ALDH1A1SMN1; SMN2MAPK1
SCHEMBL25305035 0.80 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2MAPK1CYP3A4POLB
SCHEMBL3237819 0.80 CES2 (0.37) ALDH1A1SMN1; SMN2MAPK1CYP3A4POLB
SCHEMBL20670043 0.80 POLB (0.39) ALDH1A1SMN1; SMN2MAPK1CYP3A4TDP1
Hydrochloric Acid SCHEMBL4355572 0.79 CYP3A4 (0.52) CA1CA2ALDH1A1SMN1; SMN2MAPK1
SCHEMBL5037304 0.79 ALDH1A1 (0.39) CA1CA2ALDH1A1SMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1457511-B1 CROSSLINKABLE AROMATIC RESINS HAVING PROTONIC ACID GROUPS AND ION CONDUCTIVE POLYMER MEMBRANES BINDERS AND FUEL CELLS MADE BY USING THE SAME MITSUI CHEMICALS INC (JP) 2009-07-15 EP disclosed
US-7345135-B2 Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin MITSUI CHEMICALS, INC. (JP) 2008-03-18 US disclosed
US-20040191602-A1 Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin MITSUI CHEMICALS, INC. (JP) 2004-09-30 US disclosed
EP-1457511-A1 CROSSLINKABLE AROMATIC RESINS HAVING PROTONIC ACID GROUPS AND ION CONDUCTIVE POLYMER MEMBRANES BINDERS AND FUEL CELLS MADE BY USING THE SAME Mitsui Chemicals, Inc. (JP) 2004-09-15 EP disclosed