SCHEMBL21551842

SCHEMBL21551842

CCC(=O)c1ccc2c(c1)C(C)(C)c1cc(Sc3ccccc3)ccc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ RXRA P19793 2/20 0.44
▸ RXRB P28702 2/20 0.44
▸ RXRG P48443 2/20 0.44
▸ RARB P10826 1/20 0.44
▸ RARG P13631 1/20 0.44
▸ CYP26A1 O43174 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ EZH2 Q15910 1/20 0.40
▸ BCL2 P10415 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ LMNA P02545 1/20 0.35
▸ PDK2 Q15119 3/20 0.34

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
SCHEMBL21560724 0.89 RXRA (0.40) HPGDALDH1A1RXRARXRBRXRG
SCHEMBL21552335 0.89 HPGD (0.43) HPGDALDH1A1RXRARXRBRXRG
SCHEMBL21551838 0.88 RARB (0.41) HPGDALDH1A1RXRARXRBRXRG
SCHEMBL21560535 0.88 SMN1; SMN2 (0.39) HPGDALDH1A1RXRARXRBRXRG
SCHEMBL21551972 0.85 MAPT (0.44) HPGDALDH1A1RXRARXRBRXRG
SCHEMBL21552097 0.83 RARB (0.38) HPGDALDH1A1RXRARXRBRXRG
SCHEMBL18235870 0.82 PDK2 (0.45) SMN1; SMN2L3MBTL1MAPTPDK2ATM
SCHEMBL21551952 0.79 HPGD (0.44) HPGDALDH1A1RXRARXRBRXRG
SCHEMBL21551928 0.79 SMN1; SMN2 (0.44) HPGDALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4256193 0.79 SMN1; SMN2 (0.63) HPGDALDH1A1SMN1; SMN2L3MBTL1MAPT

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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