SCHEMBL11208205

SCHEMBL11208205

Clc1cccc(C=Cc2c[nH]cn2)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NPC1 O15118 2/20 0.36
HSP90AA1 P07900 1/20 0.36
AGTR1 P30556 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
PPP1R15A O75807 1/20 0.35
MELK Q14680 1/20 0.35
PPP1R15B Q5SWA1 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PTGS2 P35354 1/20 0.35
KDM4E B2RXH2 3/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 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
SCHEMBL11204854 0.83 MAPT (0.49) MEN1KMT2ANPC1HSP90AA1L3MBTL1
SCHEMBL16597732 0.76 NPC1 (0.57) MEN1KMT2ANPC1HSP90AA1AGTR1
SCHEMBL16597730 0.76 NPC1 (0.57) MEN1KMT2ANPC1HSP90AA1AGTR1
SCHEMBL11206134 0.75 RAB9A (0.33) NPC1KDM4EMAPTCYP1A2MAPK1
SCHEMBL2559133 0.75 KMT2A (0.45) MEN1KMT2ANPC1PTGS2ALDH1A1
SCHEMBL2559134 0.75 KMT2A (0.45) MEN1KMT2ANPC1PTGS2ALDH1A1
SCHEMBL11273357 0.74 ACP1 (0.35)
SCHEMBL11206145 0.74 TAAR1 (0.36)
SCHEMBL11208373 0.72 TAAR1 (0.36)
SCHEMBL4712450 0.70 KMT2A (0.53) HDAC4HDAC1MEN1KMT2ANPC1

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-0034474-B1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Farmos-Yhtyma Oy (FI) 1983-01-26 EP disclosed
US-4333947-A HYPOTENSIVE AGENTS, BACTERICIDES, FUNGICIDES FARMOS-YHTYMA OY (FI) 1982-06-08 US disclosed
EP-0034474-A1 Substituted imidazoles, their preparation and pharmaceutical compositions containing the same Farmos-Yhtyma Oy (FI) 1981-08-26 EP disclosed