SCHEMBL18800952

SCHEMBL18800952

CCCCC/C=C\C/C=C\CCC/C=C/CCCOCCCC1(CCCOCCCCCCCC/C=C\C/C=C\CCCCC)CNC1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 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
SCHEMBL18784338 0.97 ALDH1A1 (0.42) TRPV1ALDH1A1CNR1CNR2
SCHEMBL18784335 0.97 ALDH1A1 (0.42) TRPV1ALDH1A1CNR1CNR2
SCHEMBL18800953 0.97 ALDH1A1 (0.42) TRPV1ALDH1A1CNR1CNR2
SCHEMBL18784597 0.92 ALDH1A1 (0.42) TRPV1ALDH1A1CNR1CNR2
SCHEMBL18784264 0.92 ALDH1A1 (0.42) TRPV1ALDH1A1CNR1CNR2
SCHEMBL18784289 0.85 TRPV1 (0.46) TRPV1ALDH1A1
SCHEMBL18784288 0.85 TRPV1 (0.46) TRPV1ALDH1A1
SCHEMBL18800993 0.85 ALDH1A1 (0.43) TRPV1ALDH1A1CNR1CNR2
SCHEMBL22423619 0.84 ALDH1A1 (0.36) ALDH1A1CNR1CNR2
SCHEMBL22423629 0.84 TRPV1 (0.44) TRPV1ALDH1A1

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
EP-3162794-A1 CATIONIC LIPID Kyowa Hakko Kirin Co., Ltd. (JP) 2017-05-03 EP disclosed