SCHEMBL8540369

SCHEMBL8540369

Cc1cc(Cl)cc(/C=C(/NC(=O)c2cccc(NC(=N)N)c2)C(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
KCNK3 O14649 5/20 0.41
KCNK9 Q9NPC2 4/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HPGD P15428 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 3/20 0.39
ALOX12 P18054 1/20 0.39
STAT1 P42224 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
POLB P06746 1/20 0.38
KCNH2 Q12809 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL8541777 0.93 ALDH1A1 (0.42) KDM4EKCNK3KCNK9NPC1RAB9A
SCHEMBL8542887 0.88 KCNK3 (0.46) KDM4EKCNK3KCNK9NPC1RAB9A
SCHEMBL8539479 0.88 ALDH1A1 (0.46) KDM4EKCNK3KCNK9NPC1RAB9A
SCHEMBL8539549 0.84 KDM4E (0.47) KDM4EKCNK3KCNK9NPC1RAB9A
SCHEMBL7497380 0.79 KMT2A (0.50) KCNK3KCNK9NPC1MAPTKMT2A
SCHEMBL7506955 0.79 KMT2A (0.50) KCNK3KCNK9NPC1MAPTKMT2A
SCHEMBL8538091 0.79 KMT2A (0.46) KDM4EKCNK3KCNK9NPC1RAB9A
SCHEMBL8539492 0.77 MAPT (0.49) KCNK3KCNK9RAB9AALDH1A1NPSR1
SCHEMBL8544854 0.73 RAB9A (0.42) KCNK3KCNK9NPC1RAB9AALDH1A1
SCHEMBL8538020 0.69 ITGB3 (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5852210-A Cinnamic acid derivatives G. D. SEARLE & CO. (US) 1998-12-22 US claimed