SCHEMBL28288554

SCHEMBL28288554

CC=CCCC=CCC=C(C)C=O

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
FFAR1 O14842 1/20 0.31
CYP19A1 P11511 1/20 0.31
RXRA P19793 1/20 0.31
PPARG P37231 1/20 0.31
OXER1 Q8TDS5 1/20 0.31
F13A1 P00488 1/20 0.31
THRB P10828 1/20 0.31
PTGS1 P23219 1/20 0.31
FASN P49327 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL11645545 0.85 BTN3A1 (0.33) ALDH1A1PPARG
SCHEMBL11645540 0.85 BTN3A1 (0.33) ALDH1A1PPARG
SCHEMBL728556 0.78 KMT2A (0.37) ALDH1A1MAPTFFAR1CYP19A1RXRA
SCHEMBL728557 0.78 KMT2A (0.37) ALDH1A1MAPTFFAR1CYP19A1RXRA
SCHEMBL11331795 0.77 SOAT1 (0.35) MAPTCYP19A1PPARGPTGS1
SCHEMBL10071853 0.74 ALDH1A1 (0.42) ALDH1A1MAPTFFAR1CYP19A1RXRA
SCHEMBL9125072 0.74 ALDH1A1 (0.39) ALDH1A1
SCHEMBL23291745 0.71 ALDH1A1 (0.31) ALDH1A1MAPTF13A1THRBPTGS1
SCHEMBL9808780 0.69 ALDH1A1 (0.39) ALDH1A1MAPTFFAR1CYP19A1RXRA
SCHEMBL9808775 0.69 ALDH1A1 (0.39) ALDH1A1MAPTFFAR1CYP19A1RXRA

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
CN-106083507-B A kind of preparation method of lycopene 肇庆巨元生化有限公司 2019-04-30 CN disclosed