SCHEMBL25939713

SCHEMBL25939713

O=C(ON1CC=CC1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
F2 P00734 1/20 0.50
TSHR P16473 5/20 0.47
TDP1 Q9NUW8 3/20 0.42
TP53 P04637 1/20 0.42
KMT2A Q03164 6/20 0.42
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
POLB P06746 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
MEN1 O00255 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNA5 P30532 1/20 0.40

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
SCHEMBL27045573 0.81 F2 (0.47) LMNAF2TSHRTDP1TP53
SCHEMBL2510973 0.80 KMT2A (0.50) LMNAF2TSHRTP53KMT2A
SCHEMBL28495717 0.78 HPGD (0.53) LMNAF2TSHRTP53KMT2A
SCHEMBL1249246 0.78 HPGD (0.53) LMNAF2TSHRTP53KMT2A
SCHEMBL25796422 0.77 F2 (0.47) LMNAF2TSHRTDP1TP53
SCHEMBL25771035 0.77 LMNA (0.47) LMNAF2TSHRTDP1TP53
SCHEMBL1266020 0.77 F2 (0.47) LMNAF2TSHRTDP1TP53
SCHEMBL29098438 0.77 HPGD (0.52) LMNAF2TSHRTP53KMT2A
SCHEMBL24120719 0.76 SIGMAR1 (0.56) LMNAF2TSHRKMT2AALDH1A1
SCHEMBL226315 0.76 KMT2A (0.55) LMNATSHRKMT2AMAPTALDH1A1

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-2023141852-A1 CDK2 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF 益方生物科技(上海)股份有限公司 2023-08-03 WO disclosed