SCHEMBL29970876

SCHEMBL29970876

CCc1ccc2ccc(O)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 3/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ESR2 Q92731 4/20 0.39
ESR1 P03372 3/20 0.39
ESRRB O95718 1/20 0.39
ESRRA P11474 1/20 0.39
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
ALOX15 P16050 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TERT O14746 1/20 0.37
PARP1 P09874 1/20 0.37
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
ENPP2 Q13822 1/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 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
SCHEMBL7836070 0.86 ESR2 (0.50) MEN1KMT2AESR2ESR1ESRRB
SCHEMBL29793267 0.86 ESR2 (0.50) MEN1KMT2AESR2ESR1ESRRB
SCHEMBL18571601 0.79 ALDH1A1 (0.42) MEN1KMT2AALDH1A1CASP1CASP7
SCHEMBL10778962 0.79 LTB4R (0.53) MEN1KMT2AALDH1A1CASP1CASP7
SCHEMBL16284370 0.78 CYP1A2 (0.57) KMT2AALDH1A1ESR1GAAMAPT
SCHEMBL2756576 0.78 CYP1A2 (0.47) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL7833593 0.77 HSD17B10 (0.45) GAATERTPARP1GPBAR1CYSLTR1
SCHEMBL13878246 0.76 NR4A2 (0.46) MEN1KMT2ATERTPOLBCYSLTR1
SCHEMBL12516490 0.76 TERT (0.50) MEN1KMT2AALDH1A1CASP1CASP7
SCHEMBL17179265 0.76 PDE10A (0.45) KMT2ATERTKDM4ECYSLTR1CYP1A2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661537-A Nucleoside compound, preparation method thereof, composition thereof and application of nucleoside compound in medicine 中国科学院上海药物研究所 2025-03-21 CN disclosed
CN-115279756-A METTL3 modulators 埃克森特治疗公司 2022-11-01 CN disclosed