SCHEMBL11656623

SCHEMBL11656623

CCSc1ccc(N=CN(C)C(=O)Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ AR P10275 1/20 0.32
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ HPGD P15428 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ DDR1 Q08345 1/20 0.30
▸ ITGB2 P05107 1/20 0.30
▸ ICAM1 P05362 1/20 0.30
▸ ITGAL P20701 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL11653881 0.85 KMT2A (0.45) KMT2AALDH1A1MAPTMEN1HPGD
SCHEMBL11658191 0.81 KMT2A (0.65) KMT2AMAPTMEN1L3MBTL1
Hydrochloric Acid SCHEMBL11658393 0.80 KMT2A (0.40) KMT2AALDH1A1MAPTMEN1KDM4E
Hydrochloric Acid SCHEMBL11661831 0.79 KMT2A (0.63) KMT2AMAPTMEN1L3MBTL1
SCHEMBL11658396 0.78 KMT2A (0.49) KMT2AALDH1A1MAPTMEN1HPGD
SCHEMBL11658757 0.77 KMT2A (0.42) KMT2AALDH1A1HPGDKDM4EL3MBTL1
SCHEMBL11654445 0.75 KMT2A (0.49) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL11658283 0.75 KMT2A (0.49) KMT2AALDH1A1MAPTMEN1HPGD
SCHEMBL11662704 0.74 THRB (0.32) KMT2AALDH1A1MAPTMEN1AR
SCHEMBL11655245 0.74 KMT2A (0.44) KMT2AALDH1A1MAPTMEN1MRGPRX4

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-4073636-A Azolylamidine compounds and herbicidal compositions BAYER AKTIENGESELLSCHAFT (DT) 1978-02-14 — — US disclosed
US-3993469-A Azolylamidine compounds and herbicidal compositions BAYER AKTIENGESELLSCHAFT (DT) 1976-11-23 — — US disclosed
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