SCHEMBL9424767

SCHEMBL9424767

CCC(ON1C(=O)c2ccccc2C1=O)C(=O)NCc1ccccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.62
ALDH1A1 P00352 3/20 0.57
TP53 P04637 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
HTT P42858 2/20 0.45
TSHR P16473 2/20 0.44
EPHX2 P34913 1/20 0.42
P2RX7 Q99572 1/20 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
SCHEMBL9425263 0.79 ALDH1A1 (0.68) KMT2AALDH1A1TP53NPC1RAB9A
SCHEMBL15446257 0.77 KMT2A (0.47) KMT2AALDH1A1NPC1RAB9AHTT
SCHEMBL2913379 0.76 ALDH1A1 (0.75) KMT2AALDH1A1TP53NPC1RAB9A
SCHEMBL29355696 0.74 ALDH1A1 (0.46) KMT2AALDH1A1TP53
SCHEMBL14644040 0.72 ALDH1A1 (0.57) KMT2AALDH1A1NPC1RAB9AHTT
SCHEMBL10638036 0.72 ALDH1A1 (0.57) KMT2AALDH1A1TP53NPC1RAB9A
SCHEMBL2943082 0.72 ALDH1A1 (0.73) KMT2AALDH1A1NPC1RAB9AHTT
SCHEMBL27865837 0.72 L3MBTL1 (0.44) KMT2AALDH1A1HTT
SCHEMBL21435278 0.72 ALDH1A1 (0.68) KMT2AALDH1A1TP53NPC1RAB9A
SCHEMBL9424898 0.72 ALDH1A1 (0.73) KMT2AALDH1A1TP53NPC1RAB9A

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-5314865-A Certain alkylidine aminooxyamide compounds useful as herbicides ICI AMERICAS INC. (US) 1994-05-24 US disclosed
US-5002605-A Herbicides ICI AMERICAS INC. (US) 1991-03-26 US disclosed