SCHEMBL29574657

SCHEMBL29574657

O=C(O)c1ccncc1-c1c(F)cccc1OC(F)F

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
GPBAR1 Q8TDU6 1/20 0.37
KDM4C Q9H3R0 13/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KDM6B O15054 1/20 0.37
KDM4A O75164 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
KDM4D Q6B0I6 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TAS2R14 Q9NYV8 1/20 0.36
POLB P06746 1/20 0.35
KDM5A P29375 1/20 0.35
KDM5B Q9UGL1 1/20 0.35
ALB P02768 1/20 0.35
SYK P43405 1/20 0.34

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
SCHEMBL22717805 1.00 KMT2A (0.39) KMT2AGPBAR1KDM4CKDM4EMEN1
SCHEMBL22717701 0.87 L3MBTL1 (0.44) KMT2AGPBAR1KDM4EALDH1A1L3MBTL1
SCHEMBL25153545 0.85 GPBAR1 (0.50) GPBAR1KDM4C
SCHEMBL31019033 0.85 GPBAR1 (0.50) GPBAR1KDM4C
SCHEMBL29574048 0.82 KDM4C (0.42) KMT2AGPBAR1KDM4CKDM4EMEN1
SCHEMBL22717553 0.82 KDM4C (0.42) KMT2AGPBAR1KDM4CKDM4EMEN1
SCHEMBL29695033 0.80 POLQ (0.50) KMT2ATAS2R14POLB
SCHEMBL24501117 0.80 POLQ (0.50) KMT2ATAS2R14POLB
SCHEMBL31083513 0.79 ALB (0.44) KMT2AKDM4CKDM4EMEN1KDM6B
SCHEMBL22718078 0.77 EIF4EBP1 (0.41) KMT2AALDH1A1TAS2R14

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-3976608-A1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS Ideaya Biosciences, Inc. (US) 2022-04-06 EP disclosed