SCHEMBL25955024

SCHEMBL25955024

O=c1[nH]c(=O)c2ccc(-c3ccccc3Oc3ccc(C(F)(F)F)cc3)cc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.49
▸ TNKS2 Q9H2K2 4/20 0.42
▸ BRAF P15056 4/20 0.40
▸ TNKS O95271 4/20 0.39
▸ PARP2 Q9UGN5 1/20 0.39
▸ WNT3A P56704 1/20 0.39
▸ BRD4 O60885 1/20 0.38
▸ PARP1 P09874 2/20 0.38
▸ SCN5A Q14524 1/20 0.38
▸ SCN9A Q15858 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ PIK3CA P42336 1/20 0.37
▸ KIF11 P52732 1/20 0.36
▸ AR P10275 1/20 0.36
▸ MAP3K8 P41279 1/20 0.36
▸ MAP2K1 Q02750 1/20 0.36
▸ FEN1 P39748 1/20 0.36

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
SCHEMBL25429720 0.80 HSD17B10 (0.55) TRPV1TNKS2BRD4SCN5ASCN9A
SCHEMBL18190547 0.74 BRD4 (0.50) TNKS2BRD4KDM4E
SCHEMBL1458519 0.73 MAPT (0.57) PARP1KDM4ECA12CA9KIF11
SCHEMBL25429629 0.72 TRPV1 (0.46) TRPV1BRD4SCN5ASCN9AAR
SCHEMBL28672016 0.72 NCOA1 (0.62) BRD4SCN9AKIF11AR
SCHEMBL25429460 0.70 KIF11 (0.53) SCN9AKDM4EKIF11AR
SCHEMBL25340003 0.69 TRPV1 (0.38) TRPV1SCN9AKDM4EARFEN1
SCHEMBL30868535 0.69 BRAF (0.45) BRAFBRD4SCN9A
SCHEMBL31058401 0.69 JUN (0.43) TNKS2TNKSWNT3APARP1KDM4E
SCHEMBL25429840 0.69 PTGS2 (0.51) BRD4SCN9ACA9KIF11AR

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
WO-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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