SCHEMBL11068047

SCHEMBL11068047

O=C1C=C(C(=O)NCCO)c2ccccc2C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.45
HTT P42858 3/20 0.45
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HPGD P15428 1/20 0.40
KDM4E B2RXH2 4/20 0.38
MAPT P10636 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM5 P08912 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 1/20 0.37
MAOA P21397 2/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.35
CACNA1B Q00975 1/20 0.35
APBA1 Q02410 1/20 0.35

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
SCHEMBL26339667 0.79 ALDH1A1 (0.41) ALDH1A1MTNR1AMTNR1BSMN1; SMN2KDM4E
SCHEMBL11792548 0.77 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2HPGDKDM4EMAOA
SCHEMBL26337520 0.75 NPC1 (0.45) ALDH1A1MTNR1AMTNR1BSMN1; SMN2HPGD
SCHEMBL703737 0.75 MAOA (0.50) ALDH1A1SMN1; SMN2KDM4ECASP7MAOA
SCHEMBL9145493 0.73 MAOA (0.44) ALDH1A1KDM4ECASP7MAOAMEN1
SCHEMBL10783453 0.73 MAOA (0.44) ALDH1A1KDM4EMAPTCASP7MAOA
SCHEMBL11132312 0.73 ALDH1A1 (0.41) ALDH1A1MTNR1AMTNR1BSMN1; SMN2HPGD
SCHEMBL8719958 0.72 MAOA (0.39) ALDH1A1MTNR1AMTNR1BKDM4EMAPT
SCHEMBL11412823 0.70 GAA (0.53) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL27661294 0.70 MEN1 (0.50) ALDH1A1HTTSMN1; SMN2HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4482489-A USEFUL IN DIAZOTYPE SYSTEMS AND AS LATENT POLYMERIZATION INITIATORS JAMES RIVER GRAPHICS, INC. (US) 1984-11-13 US disclosed
EP-0071643-A1 PROCESS FOR FORMING COLORED IMAGES ON TEXTILE MATERIALS AND PHOTOSENSITIVE FILM FOR USE IN SAID PROCESS ROBILLARD, Jean J. (US) 1983-02-16 EP disclosed
WO-1982002689-A1 PROCESS FOR FORMING COLORED IMAGES ON TEXTILE MATERIALS AND PHOTOSENSITIVE FILM FOR USE IN SAID PROCESS ROBILLARD JEAN J 1982-08-19 WO disclosed
US-4306007-A Process of making and using fade-resistant diazo microfilm AM INTERNATIONAL, INC. (US) 1981-12-15 US disclosed
US-3933423-A Azoic dyeing of leather E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-01-20 US disclosed