SCHEMBL11030145

SCHEMBL11030145

CCCCCCCCCCCCC/C=C/C=C/C=C/C=C/C=C/[C]=O

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
TSHR P16473 1/20 0.59
FASN P49327 1/20 0.52
FAAH O00519 7/20 0.47
TRPV1 Q8NER1 1/20 0.47
KDM4E B2RXH2 1/20 0.44
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41

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
SCHEMBL13370196 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL1239783 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL1240686 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL9696421 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL19063519 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL18398897 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL18398895 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL17479081 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL3130547 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL1237969 1.00 ALDH1A1 (0.59) ALDH1A1TSHRFASNFAAHTRPV1

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
US-20120191434-A1 ARTICLES OF MANUFACTURE AND METHODS FOR MODELING CHINESE HAMSTER OVARY (CHO) CELL METABOLISM GT LIFE SCIENCES, INC. (US) 2012-07-26 US disclosed