SCHEMBL21560667

SCHEMBL21560667

CCC(=O)c1ccc2c(c1)C(C)(C)c1cc(SC3=CCCCC=C3)ccc1-2

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.33
▸ RARB P10826 1/20 0.33
▸ RARG P13631 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP26A1 O43174 1/20 0.31
▸ ATM Q13315 1/20 0.31

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
SCHEMBL21560719 0.83 RARB (0.33) MAPTRARBRARGRXRARXRB
SCHEMBL21551842 0.76 HPGD (0.44) MAPTRARBRARGRXRARXRB
SCHEMBL21560724 0.75 RXRA (0.40) MAPTRARBRARGRXRARXRB
SCHEMBL21551972 0.73 MAPT (0.44) MAPTRARBRARGRXRARXRB
SCHEMBL18235870 0.69 PDK2 (0.45) MAPTATM
SCHEMBL21551956 0.68 MAPT (0.39) MAPTALDH1A1HPGDTSHRATM
SCHEMBL21560535 0.68 SMN1; SMN2 (0.39) MAPTRXRARXRBRXRGALDH1A1
SCHEMBL21552335 0.66 HPGD (0.43) MAPTRARBRARGRXRARXRB
SCHEMBL21551838 0.66 RARB (0.41) RARBRARGRXRARXRBRXRG
SCHEMBL21551940 0.65 MTNR1A (0.42) MAPTRARBRARGRXRARXRB

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-2019216600-A1 NOVEL OXIME ESTER COMPOUND AND PHOTORESIST COMPOSITION COMPRISING SAME 주식회사 트리엘 (KR) 2019-11-14 — — WO disclosed
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