SCHEMBL10909115

SCHEMBL10909115

CCCCCCCCOCC(O)COc1ccc(/C=C(\C#N)C(=O)OCC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.50
MAPT P10636 9/20 0.50
KDM4E B2RXH2 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
PLA2G4B P0C869 2/20 0.48
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
CASP3 P42574 1/20 0.46
RAB9A P51151 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PDCD1 Q15116 1/20 0.46
CD274 Q9NZQ7 1/20 0.46
PKM P14618 1/20 0.46
HTT P42858 1/20 0.46
CRHBP P24387 1/20 0.44

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
SCHEMBL10909118 1.00 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EL3MBTL1PLA2G4B
SCHEMBL10911023 1.00 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EL3MBTL1PLA2G4B
SCHEMBL10911020 1.00 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EL3MBTL1PLA2G4B
SCHEMBL10693214 0.89 ALDH1A1 (0.62) ALDH1A1MAPTKDM4EL3MBTL1KMT2A
SCHEMBL27441054 0.88 ALDH1A1 (0.60) ALDH1A1MAPTKDM4EL3MBTL1KMT2A
SCHEMBL27441051 0.88 ALDH1A1 (0.60) ALDH1A1MAPTKDM4EL3MBTL1KMT2A
SCHEMBL10906893 0.87 PLA2G4B (0.53) ALDH1A1MAPTKDM4EPLA2G4BKMT2A
SCHEMBL10909228 0.87 PLA2G4B (0.53) ALDH1A1MAPTKDM4EPLA2G4BKMT2A
SCHEMBL27441049 0.86 ALDH1A1 (0.62) ALDH1A1MAPTKDM4EL3MBTL1KMT2A
SCHEMBL20357998 0.84 ALDH1A1 (0.64) ALDH1A1MAPTKDM4EL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4618638-A CAPABLE OF BINDING WITH ACRYLIC ENAMELS CIBA-GEIGY CORPORATION (US) 1986-10-21 US claimed
US-4618638-A CAPABLE OF BINDING WITH ACRYLIC ENAMELS CIBA-GEIGY CORPORATION (US) 1986-10-21 US disclosed
US-4544691-A ACRYLIC AUTOMOBILE COATINGS; WEATHERPROOFING CIBA-GEIGY CORPORATION (US) 1985-10-01 US disclosed
US-4504419-A Alpha-cyanocinnamate ultraviolet-absorbing stabilizers substituted by an aliphatic hydroxyl group CIBA-GEIGY CORPORATION (US) 1985-03-12 US disclosed
US-4496757-A Ultraviolet-absorbing stabilizers substituted an aliphatic hydroxyl group CIBA-GEIGY CORPORATION (US) 1985-01-29 US disclosed
US-4496676-A Ultraviolet-absorbing stabilizers substituted by an aliphatic hydroxyl group CIBA-GEIGY CORPORATION (US) 1985-01-29 US disclosed
US-4414393-A BENZOTRIAZOLES CIBA-GEIGY CORPORATION (US) 1983-11-08 US disclosed