SCHEMBL10831735

SCHEMBL10831735

CC(C)Oc1ccc(C(=O)N2CCNC2=Nc2cccc(Cl)c2Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ TP53 P04637 2/20 0.37
▸ GAA P10253 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 4/20 0.36
▸ CHRM5 P08912 4/20 0.35
▸ MBTPS1 Q14703 2/20 0.35
▸ PARP10 Q53GL7 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KDM4E B2RXH2 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
SCHEMBL10831645 0.91 ALDH1A1 (0.36) ALDH1A1LMNAHPGDTSHRTP53
SCHEMBL10831640 0.91 ALDH1A1 (0.36) ALDH1A1LMNAHPGDTSHRTP53
SCHEMBL10832587 0.89 SMN1; SMN2 (0.44) ALDH1A1LMNAHPGDTSHRGAA
SCHEMBL10831620 0.89 ALDH1A1 (0.45) ALDH1A1LMNAHPGDTSHRTP53
SCHEMBL10832129 0.86 NPC1 (0.47) ALDH1A1LMNAHPGDTSHRTP53
SCHEMBL10880573 0.85 POLB (0.40) GAAKMT2AMEN1MAPTPOLB
SCHEMBL10832885 0.85 POLB (0.40) GAAKMT2AMEN1MAPTPOLB
SCHEMBL10832149 0.84 ALDH1A1 (0.47) ALDH1A1LMNAHPGDTSHRTP53
SCHEMBL10831616 0.83 HSD11B1 (0.39) GAAPOLBKDM4E
SCHEMBL10832323 0.82 PTGS2 (0.42) ALDH1A1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4581460-A ANALGESICS CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-04-08 — — US disclosed
EP-0083729-A1 Substituted 1-benzoyl-2-phenylimino-imidazolidines, their acid addition salts, process for their preparation and pharmaceutical compositions containing them CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1983-07-20 — — EP disclosed
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