SCHEMBL2401608

SCHEMBL2401608

CC/C=C/CC(=O)OC(=O)C/C=C/CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.42
ADORA3 P0DMS8 2/20 0.38
NR1I2 O75469 2/20 0.38
PTGS2 P35354 2/20 0.38
PGR P06401 1/20 0.38
PDE4D Q08499 1/20 0.38
OXER1 Q8TDS5 4/20 0.37
CYP19A1 P11511 4/20 0.37
PPARG P37231 3/20 0.37
MAPT P10636 3/20 0.37
RXRA P19793 2/20 0.37
FFAR1 O14842 2/20 0.37
TDP1 Q9NUW8 4/20 0.36
ALOX15 P16050 3/20 0.36
CYP3A4 P08684 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TSHR P16473 1/20 0.36
CYP2D6 P10635 1/20 0.35
PTGS1 P23219 3/20 0.34
F7 P08709 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
SCHEMBL2401610 1.00 ALDH1A1 (0.42) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL16830186 1.00 ALDH1A1 (0.42) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL26639875 1.00 ALDH1A1 (0.42) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL26639846 1.00 ALDH1A1 (0.42) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL26639796 0.95 ALDH1A1 (0.39) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL26639867 0.95 ALDH1A1 (0.39) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL26639792 0.95 ALDH1A1 (0.39) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL16538722 0.93 ADORA3 (0.47) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL16538720 0.93 ADORA3 (0.47) ALDH1A1ADORA3NR1I2PTGS2PGR
SCHEMBL26639876 0.89 ALDH1A1 (0.62) ALDH1A1ADORA3NR1I2PTGS2PGR

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-20250354180-A1 ENZYMES, CELLS, AND METHODS FOR PRODUCING CIS-3 HEXENOL MANUS BIO INC (US) 2025-11-20 US claimed
WO-2023220728-A2 ENZYMES, CELLS, AND METHODS FOR PRODUCING CIS-3 HEXENOL MANUS BIO INC. (US) 2023-11-16 WO claimed
US-20250354180-A1 ENZYMES, CELLS, AND METHODS FOR PRODUCING CIS-3 HEXENOL MANUS BIO INC (US) 2025-11-20 US disclosed
WO-2023220728-A2 ENZYMES, CELLS, AND METHODS FOR PRODUCING CIS-3 HEXENOL MANUS BIO INC. (US) 2023-11-16 WO disclosed
WO-2011110349-A2 PROCESS FOR THE PREPARATION OF DICARBOXYLIC ACIDS OR DICARBOXYLIC ACID ESTERS BY METATHESIS EMERY OLEOCHEMICALS GMBH (DE) 2011-09-15 WO disclosed