SCHEMBL11276121

SCHEMBL11276121

CCCCCCCCCCCCCCCCCCCCC(C)(N=O)C(C)O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 7/20 0.44
FDPS P14324 11/20 0.42
SMPD1 P17405 5/20 0.41
LPAR1 Q92633 1/20 0.41
LPAR3 Q9UBY5 1/20 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
SCHEMBL10333197 0.80 FDPS (0.47) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL7169362 0.75 GGPS1 (0.47) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL6330793 0.74 LMNA (0.42) GGPS1FDPS
SCHEMBL1660093 0.74 LMNA (0.42) GGPS1FDPS
SCHEMBL8897150 0.74 LMNA (0.42) GGPS1FDPS
SCHEMBL6322458 0.74 LMNA (0.42) GGPS1FDPS
SCHEMBL7077628 0.73 GGPS1 (0.41) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL29743378 0.72 FDPS (0.42) GGPS1FDPSSMPD1
SCHEMBL22551256 0.72 FDPS (0.42) GGPS1FDPSSMPD1
SCHEMBL24793822 0.72 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3

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-4328110-A Fabric conditioning articles and methods of use BEECHAM INC. (US) 1982-05-04 US disclosed
EP-0048163-A2 Fabric conditioning articles and methods of use BEECHAM INC. (US) 1982-03-24 EP disclosed
US-4292412-A Hydrophilic, fabric softener foam compositions and method of making W. R. GRACE & CO. (US) 1981-09-29 US disclosed
US-4134838-A Fabric conditioning product LEVER BROTHERS COMPANY (US) 1979-01-16 US disclosed
US-4129694-A Fabric softener urethane foam and method W. R. GRACE & CO. (US) 1978-12-12 US disclosed