SCHEMBL8540372

SCHEMBL8540372

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 4/20 0.37
KCNK9 Q9NPC2 3/20 0.37
MEN1 O00255 7/20 0.35
KMT2A Q03164 7/20 0.35
NPC1 O15118 5/20 0.35
RAB9A P51151 5/20 0.35
PARP1 P09874 1/20 0.33
PARP15 Q460N3 1/20 0.33
PARP10 Q53GL7 1/20 0.33
MAPT P10636 4/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL8542422 0.93 PARP1 (0.36) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8536787 0.88 PARP1 (0.40) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8538564 0.88 PARP1 (0.40) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8539554 0.85 CA1 (0.38) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8542528 0.82 SMN1; SMN2 (0.34) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8538385 0.81 KCNK3 (0.43) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8538807 0.80 KCNK3 (0.42) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8542364 0.80 CES2 (0.47) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8538094 0.80 CES2 (0.42) KCNK3KCNK9MEN1KMT2ANPC1
SCHEMBL8544139 0.79 KAT6A (0.38) RAB9APARP1PARP15PARP10MAPT

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