SCHEMBL9565397

SCHEMBL9565397

COCCOc1cccc(C(=O)Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
SMPD1 P17405 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.48
MEN1 O00255 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
NR1H4 Q96RI1 2/20 0.46
THRB P10828 1/20 0.46
CHEK1 O14757 1/20 0.45
CHEK2 O96017 1/20 0.45
PRSS1 P07477 2/20 0.45

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
SCHEMBL30785561 1.00 KMT2A (0.54) KMT2ASMPD1L3MBTL1ALDH1A1KDM4E
SCHEMBL3487082 0.92 KMT2A (0.53) KMT2ASMPD1KDM4EMAPK1NR1H4
SCHEMBL28294885 0.87 L3MBTL1 (0.57) KMT2ASMPD1L3MBTL1ALDH1A1KDM4E
SCHEMBL10989423 0.85 MAOB (0.60) KMT2AALDH1A1MEN1
SCHEMBL30517635 0.85 KMT2A (0.73) KMT2ASMPD1NR1H4
SCHEMBL1665037 0.85 KMT2A (0.55) KMT2ASMPD1L3MBTL1ALDH1A1KDM4E
SCHEMBL1665041 0.85 KMT2A (0.73) KMT2ASMPD1NR1H4
SCHEMBL5200730 0.85 KMT2A (0.73) KMT2ASMPD1ALDH1A1LMNAMAPK1
SCHEMBL6356224 0.85 KMT2A (0.47) KMT2ASMPD1LMNACES2CES1
SCHEMBL11422303 0.85 PRSS1 (0.60) KMT2ASMPD1THRBPRSS1

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
CN-1076694-A Novel herbicide RHONE POUIENC AGRICUITURE LTD (GB) 1993-09-29 CN disclosed
EP-0560483-A1 4 Benzopyl isoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-09-15 EP disclosed