SCHEMBL24769729

SCHEMBL24769729

COc1cnc(Cl)cc1-c1ccccc1C(C)=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
POLQ O75417 8/20 0.42
RORB Q92753 2/20 0.42
RORC P51449 1/20 0.42
KDM4C Q9H3R0 1/20 0.41
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
DHFR P00374 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.39

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
SCHEMBL24769722 0.83 KCNQ3 (0.43) POLQDHFR
SCHEMBL24770364 0.76 POLQ (0.44) POLQDHFR
SCHEMBL31032174 0.76 POLQ (0.70) POLQ
SCHEMBL16368532 0.76 HTT (0.46) SMN1; SMN2LMNAL3MBTL1POLQHTT
SCHEMBL31248788 0.76 HTT (0.46) SMN1; SMN2LMNAL3MBTL1POLQHTT
SCHEMBL1957953 0.75 SMN1; SMN2 (0.56) SMN1; SMN2LMNAL3MBTL1MAPTHTT
SCHEMBL31297029 0.75 CLCN2 (0.47) L3MBTL1POLQMAPTHTTALDH1A1
SCHEMBL30858965 0.74 POLB (0.49) L3MBTL1POLQALDH1A1RAB9A
SCHEMBL14610550 0.74 HDAC4 (0.60) LMNAL3MBTL1MAPTHTTALDH1A1
SCHEMBL14003500 0.74 MAPT (0.57) SMN1; SMN2LMNAL3MBTL1MAPTHTT

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-2022259204-A1 O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2022-12-15 WO disclosed