SCHEMBL7999840

SCHEMBL7999840

CCCCCCCC/C=C\CCCCCCCCCCCCNCCO

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
CNR1 P21554 2/20 0.53
HPGD P15428 2/20 0.53
TRPV1 Q8NER1 2/20 0.53
CNR2 P34972 1/20 0.53
MEN1 O00255 1/20 0.53
MAPT P10636 1/20 0.53
ALOX12 P18054 1/20 0.53
BLM P54132 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
TSHR P16473 1/20 0.52
FAAH O00519 2/20 0.52
TRPM8 Q7Z2W7 1/20 0.50

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
SCHEMBL359429 1.00 ALDH1A1 (0.53) ALDH1A1CNR1HPGDTRPV1CNR2
SCHEMBL7999843 1.00 ALDH1A1 (0.53) ALDH1A1CNR1HPGDTRPV1CNR2
SCHEMBL8459195 1.00 ALDH1A1 (0.53) ALDH1A1CNR1HPGDTRPV1CNR2
SCHEMBL19032670 1.00 ALDH1A1 (0.53) ALDH1A1CNR1HPGDTRPV1CNR2
SCHEMBL19032668 1.00 ALDH1A1 (0.53) ALDH1A1CNR1HPGDTRPV1CNR2
SCHEMBL359431 1.00 ALDH1A1 (0.53) ALDH1A1CNR1HPGDTRPV1CNR2
Hydrochloric Acid SCHEMBL7073709 0.98 ALDH1A1 (0.51) ALDH1A1CNR1HPGDTRPV1CNR2
SCHEMBL7490711 0.98 ALDH1A1 (0.51) ALDH1A1CNR1HPGDTRPV1CNR2
Hydrochloric Acid SCHEMBL7073702 0.98 ALDH1A1 (0.51) ALDH1A1CNR1HPGDTRPV1CNR2
Hydrochloric Acid SCHEMBL8629416 0.98 ALDH1A1 (0.51) ALDH1A1CNR1HPGDTRPV1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6291406-B1 FRACTURING FLUID OR DRILLING FLUID WHICH COMPRISES A WATER-IN-OIL EMULSION CONTAINING AN AMINE OR AMINE OXIDE SURFACTANT THE DOW CHEMICAL COMPANY 2001-09-18 US disclosed
WO-2000022063-A1 METHOD FOR TREATING SUBTERRANEAN FORMATIONS THE DOW CHEMICAL COMPANY (US) 2000-04-20 WO disclosed