SCHEMBL26935005

SCHEMBL26935005

CC(C)c1ccc(/C=N/Nc2ccc(C(=O)O)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 1.00
SMN1; SMN2 Q16637 8/20 1.00
MITF O75030 4/20 1.00
HPGD P15428 3/20 1.00
ALDH1A1 P00352 3/20 1.00
GAA P10253 13/20 0.67
MEN1 O00255 9/20 0.67
KMT2A Q03164 9/20 0.67
RAB9A P51151 15/20 0.63
NPC1 O15118 14/20 0.63
KDM4E B2RXH2 4/20 0.60
NFKB1 P19838 3/20 0.60
NFKB2 Q00653 3/20 0.60
RELA Q04206 3/20 0.60
POLB P06746 3/20 0.60
HSP90AA1 P07900 1/20 0.60
PKM P14618 3/20 0.57
ATM Q13315 2/20 0.57
APEX1 P27695 1/20 0.56
CASP6 P55212 1/20 0.56

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
SCHEMBL26915313 1.00 MAPT (1.00) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL29859752 0.84 MAPT (0.72) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL26915293 0.84 MAPT (0.72) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL26935144 0.84 MAPT (0.72) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL2681914 0.82 RAB9A (0.74) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL714966 0.82 RAB9A (0.74) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL714967 0.82 RAB9A (0.74) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL26935149 0.82 MAPT (0.68) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL3272232 0.82 MAPT (0.68) MAPTSMN1; SMN2MITFHPGDALDH1A1
SCHEMBL26935010 0.80 MAPT (1.00) MAPTSMN1; SMN2MITFHPGDALDH1A1

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-4289422-A1 AGENT FOR SUPPRESSING IL-31 PRODUCTION AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Kyushu University, National University Corporation (JP) 2023-12-13 EP disclosed