SCHEMBL10112873

SCHEMBL10112873

O=C(c1cc[nH]c1)c1cc(Cl)ccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
TP53 P04637 2/20 0.50
HTT P42858 1/20 0.42
LMNA P02545 3/20 0.42
TSHR P16473 2/20 0.42
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
TYK2 P29597 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
SRD5A2 P31213 1/20 0.41
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
RECQL P46063 1/20 0.41
MAPT P10636 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40

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
SCHEMBL9686342 0.84 RECQL (0.54) ALDH1A1HTTALOX15RECQLMAPT
SCHEMBL7230843 0.79 ALDH1A1 (0.53) ALDH1A1LMNACYP1A2HPGDCYP2C19
SCHEMBL7466437 0.78 ALDH1A1 (0.61) ALDH1A1TP53LMNATSHRALOX15
SCHEMBL8160214 0.78 ALDH1A1 (0.71) ALDH1A1TP53LMNATSHRJAK2
SCHEMBL3590906 0.77 SRD5A2 (0.55) ALDH1A1HTTTSHRALOX15HPGD
SCHEMBL230930 0.75 ALDH1A1 (0.63) ALDH1A1TP53HTTLMNAALOX15
SCHEMBL29612638 0.75 ALDH1A1 (0.63) ALDH1A1TP53HTTLMNAALOX15
SCHEMBL9686334 0.75 MAPT (0.48) ALDH1A1TP53HTTLMNACYP1A2
SCHEMBL612249 0.74 MAPK1 (0.62) ALDH1A1TP53HTTLMNAHPGD
SCHEMBL9528563 0.73 ALDH1A1 (0.43) ALDH1A1HTTLMNAHPGDSRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729219-B2 Polyarylene block copolymer having sulfonic acid group and use thereof JSR CORPORATION (JP) 2014-05-20 US disclosed
US-8729219-B2 Polyarylene block copolymer having sulfonic acid group and use thereof JSR CORPORATION (JP) 2014-05-20 US disclosed
US-20130085236-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF JSR CORPORATION (JP) 2013-04-04 US disclosed
US-20130085236-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF JSR CORPORATION (JP) 2013-04-04 US disclosed
US-20120052412-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF HONDA MOTOR CO., LTD. (JP) 2012-03-01 US disclosed
US-20120052412-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF HONDA MOTOR CO., LTD. (JP) 2012-03-01 US disclosed