SCHEMBL11266853

SCHEMBL11266853

CCCCCCCCCCCCCCCCCCCCCCC(C)P=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
ADH1B P00325 1/20 0.43
ADH1C P00326 1/20 0.43
ADH1A P07327 1/20 0.43
ADH4 P08319 1/20 0.43
ADH7 P40394 1/20 0.43
ACE2 Q9BYF1 1/20 0.42
GPR84 Q9NQS5 3/20 0.41
FDPS P14324 3/20 0.41
SPHK1 Q9NYA1 1/20 0.41
FFAR1 O14842 1/20 0.41
CA1 P00915 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
TP53 P04637 1/20 0.40
DNM1 Q05193 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40

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
SCHEMBL3636316 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL28318831 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL408729 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL10933873 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL10935091 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL6189573 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL10495885 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL4707701 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL7747375 0.90
SCHEMBL8370133 0.90

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