SCHEMBL10832636

SCHEMBL10832636

COc1cc(C(=O)N2CCNC2=Nc2c(Cl)cccc2Cl)cc(OC)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ LMNA P02545 3/20 0.45
▸ THRB P10828 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ TUBB4A P04350 2/20 0.42
▸ TUBB P07437 2/20 0.42
▸ TUBA3C P0DPH7 2/20 0.42
▸ TUBA1B P68363 2/20 0.42
▸ TUBA4A P68366 2/20 0.42
▸ TUBB4B P68371 2/20 0.42
▸ TUBB3 Q13509 2/20 0.42
▸ TUBB2A Q13885 2/20 0.42
▸ TUBB8 Q3ZCM7 2/20 0.42
▸ TUBA3E Q6PEY2 2/20 0.42
▸ TUBA1A Q71U36 2/20 0.42
▸ TUBA1C Q9BQE3 2/20 0.42
▸ TUBB6 Q9BUF5 2/20 0.42

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
SCHEMBL10832630 1.00 ALDH1A1 (0.46) ALDH1A1CYP1A2LMNATHRBMEN1
SCHEMBL10832466 0.89 PDE4D (0.45) ALDH1A1LMNACYP2C19GAAPOLB
SCHEMBL10832468 0.89 PDE4D (0.45) ALDH1A1LMNACYP2C19GAAPOLB
SCHEMBL10832490 0.88 HSD11B1 (0.40) ALDH1A1LMNAMEN1KMT2AGAA
SCHEMBL10832493 0.88 HSD11B1 (0.40) ALDH1A1LMNAMEN1KMT2AGAA
SCHEMBL10832289 0.87 GPR6 (0.43) ALDH1A1KMT2AL3MBTL1
SCHEMBL10832293 0.87 GPR6 (0.43) ALDH1A1KMT2AL3MBTL1
SCHEMBL10831650 0.84 SMN1; SMN2 (0.47) ALDH1A1LMNAL3MBTL1CYP2C19GAA
SCHEMBL10831654 0.84 SMN1; SMN2 (0.47) ALDH1A1LMNAL3MBTL1CYP2C19GAA
SCHEMBL10832451 0.84 GPR6 (0.45) ALDH1A1CYP1A2THRBMEN1KMT2A

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
US-4581460-A ANALGESICS CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-04-08 — — US disclosed
EP-0083729-B1 SUBSTITUTED 1-BENZOYL-2-PHENYLIMINO-IMIDAZOLIDINES, THEIR ACID ADDITION SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-02-26 — — EP 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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