SCHEMBL11859516

SCHEMBL11859516

CCCCCC(=O)C=C[C@@H]1[C@@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.67
▸ ABCC4 O15439 2/20 0.67
▸ POLB P06746 2/20 0.67
▸ ALDH1A1 P00352 1/20 0.67
▸ PGR P06401 1/20 0.67
▸ MAPT P10636 1/20 0.67
▸ NPSR1 Q6W5P4 1/20 0.67
▸ ABCB11 O95342 1/20 0.67
▸ PTGIR P43119 8/20 0.58
▸ PTGER2 P43116 6/20 0.58
▸ TSHR P16473 2/20 0.56
▸ PTGER4 P35408 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ HPGD P15428 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ ABCC3 O15438 1/20 0.56
▸ RARB P10826 1/20 0.56
▸ RARG P13631 1/20 0.56

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
SCHEMBL11743269 1.00 LMNA (0.67) LMNAABCC4POLBALDH1A1PGR
SCHEMBL11859148 0.99 LMNA (0.66) LMNAABCC4POLBALDH1A1PGR
SCHEMBL11859156 0.99 LMNA (0.66) LMNAABCC4POLBALDH1A1PGR
SCHEMBL11859163 0.99 LMNA (0.66) LMNAABCC4POLBALDH1A1PGR
SCHEMBL11868211 0.90 LMNA (0.56) LMNAABCC4POLBALDH1A1PGR
SCHEMBL11868216 0.90 LMNA (0.56) LMNAABCC4POLBALDH1A1PGR
SCHEMBL11868224 0.90 LMNA (0.56) LMNAABCC4POLBALDH1A1PGR
SCHEMBL11866030 0.88 PTGIR (0.71) LMNAABCC4POLBALDH1A1PGR
SCHEMBL7744902 0.88 PTGIR (0.71) LMNAABCC4POLBALDH1A1PGR
SCHEMBL9487052 0.88 PTGIR (0.71) LMNAABCC4POLBALDH1A1PGR

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-3992411-A 2α-Formyl-3β-[(methoxalyl)oxy]-5-oxo-1β-cyclopentaneheptanoic acid and process MERCK & CO., INC. (US) 1976-11-16 — — US disclosed
Send feedback