SCHEMBL9526794

SCHEMBL9526794

CC1(C(=O)O)Cc2ccccc2C1Cl

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GCK P35557 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
HBB P68871 1/20 0.38
SIGMAR1 Q99720 2/20 0.38
LMNA P02545 1/20 0.36
BLM P54132 1/20 0.36
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL856897 0.76 CYP2D6 (0.36) GCKALDH1A1MAPTTSHRKDM4E
SCHEMBL9770016 0.73 HDAC4 (0.37) GCKALDH1A1TSHRLMNABLM
SCHEMBL6266713 0.70 ADRA2A (0.40) GCKALDH1A1MAPTTSHRKDM4E
SCHEMBL19852061 0.69 ALDH1A1 (0.40) GCKALDH1A1MAPTTSHRKDM4E
SCHEMBL5334825 0.69 ALDH1A1 (0.40) ALDH1A1MAPTTSHRLMNABLM
SCHEMBL9527857 0.68 ALDH1A1 (0.36) ALDH1A1TSHRSIGMAR1NPSR1
Hydrochloric Acid SCHEMBL2084296 0.68 ALDH1A1 (0.42) ALDH1A1MAPTTSHRLMNABLM
SCHEMBL9738320 0.68 ACP3 (0.43) ALDH1A1MAPTTSHRKDM4EHPGD
SCHEMBL3346965 0.68 TSHR (0.40) GCKALDH1A1MAPTTSHRKDM4E
SCHEMBL1786936 0.66 HDAC9 (0.44) LMNATDP1L3MBTL1

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
EP-0310745-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE ORION-YHTYMÄ OY (FI) 1993-01-27 EP disclosed
EP-0183492-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE Farmos-Yhtyma Oy (FI) 1989-11-15 EP disclosed
EP-0310745-A2 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÄ OY (FI) 1989-04-12 EP disclosed
US-4689339-A 4-dihydroinden-2-yl-, 4-tetrahydronaphth-2-yl-, and 4-dihydrobenzofuran-2-ylimidazoles, useful to block α2 -adrenergic receptors FARMOS YHTYMA OY (FI) 1987-08-25 US disclosed
EP-0183492-A1 Substituted imidazole derivatives and their preparation and use Farmos-Yhtyma Oy (FI) 1986-06-04 EP disclosed