SCHEMBL26347775

SCHEMBL26347775

NC(=O)c1cc(=O)[nH]c2cnccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 5/20 0.62
MAP2 P11137 1/20 0.49
KDM4E B2RXH2 4/20 0.47
HTT P42858 1/20 0.47
PARP1 P09874 1/20 0.44
SIRT3 Q9NTG7 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
APOBEC3G Q9HC16 1/20 0.42
CLK1 P49759 1/20 0.42
CDK5 Q00535 1/20 0.42
DYRK1A Q13627 1/20 0.42
CDK5R1 Q15078 1/20 0.42
BRAF P15056 1/20 0.41
KDM5C P41229 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
CHUK O15111 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
IKBKB O14920 1/20 0.41

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
SCHEMBL3242090 0.77 KDM5A (1.00) KDM5AKDM4EPARP1BRAFKDM5C
SCHEMBL30064094 0.77 KDM5A (1.00) KDM5AKDM4EPARP1BRAFKDM5C
SCHEMBL31343793 0.77 KDM4E (0.64) KDM4EALDH1A1HPGD
SCHEMBL14829872 0.77 KDM4E (0.64) KDM4EALDH1A1HPGD
SCHEMBL4357845 0.76 ALDH1A1 (0.59) MAP2KDM4EHTTSIRT3TDP1
SCHEMBL30474111 0.75 KDM5A (0.67) KDM5AKDM4EPARP1KDM5BCHUK
SCHEMBL19984551 0.75 KDM5A (0.67) KDM5AKDM4EPARP1KDM5BCHUK
SCHEMBL31546652 0.74 CHUK (0.52) KDM5AMAP2KDM4ECLK1CDK5
SCHEMBL4756721 0.73 KDM5A (0.65) KDM5AKDM4EPARP1DYRK1ABRAF
SCHEMBL246359 0.73 KDM5A (0.65) KDM5AKDM4EPARP1BRAFKDM5C

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
EP-4249480-A1 DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Northwest A&F University (CN) 2023-09-27 EP disclosed