SCHEMBL11057692

SCHEMBL11057692

CCCCCCCOC(C)N

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.56
OPRM1 P35372 1/20 0.44
CA1 P00915 8/20 0.41
CA2 P00918 8/20 0.41
CA9 Q16790 7/20 0.41
CA12 O43570 3/20 0.41
CA7 P43166 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA3 P07451 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
SPHK1 Q9NYA1 1/20 0.41
HTT P42858 1/20 0.41
TSHR P16473 1/20 0.40
THRB P10828 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
SCHEMBL115634 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL3028563 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL11299851 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL11298853 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL10520139 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL3032466 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL11300461 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL3036882 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
SCHEMBL1109713 1.00 DNM1 (0.56) DNM1OPRM1CA1CA2CA9
Hydrochloric Acid SCHEMBL8615473 0.98 DNM1 (0.59) DNM1OPRM1CA1CA2CA9

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115190904-A Use of specific open-chain ether isocyanates 科思创德国股份有限公司 2022-10-14 CN disclosed
US-4431514-A HEATING OR COOLING A HYDROCARBON STREAM; ADDING AN HYDROXY CARBOXYLIC ACID-MODIFIED POLYALKYLENE AMINE CHEVRON RESEARCH COMPANY (US) 1984-02-14 US disclosed
EP-0010256-B1 PROCESS FOR PREPARING SYMMETRIC 1,3-DISUBSTITUTED UREAS BASF Aktiengesellschaft (DE) 1982-12-29 EP disclosed
US-4269790-A Hydrocarbylethyl sulfonyl fluoride CHEVRON RESEARCH COMPANY (US) 1981-05-26 US disclosed
EP-0010256-A2 Process for preparing symmetric 1,3-disubstituted ureas BASF Aktiengesellschaft (DE) 1980-04-30 EP disclosed
US-4200518-A POLYALKYLENE-AMINES, CRUDE OILS CHEVRON RESEARCH COMPANY (US) 1980-04-29 US disclosed
US-4122266-A TO FORM LUBRICATING OIL ADDITIVES CHEVRON RESEARCH COMPANY (US) 1978-10-24 US disclosed