SCHEMBL18800993

SCHEMBL18800993

CCCCC/C=C\C/C=C\CCCCCCCCOCC1(COCCCCCCCC/C=C\C/C=C\CCCCC)CNC1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
TRPV1 Q8NER1 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
SCHEMBL22022969 0.87 ALDH1A1 (0.36) ALDH1A1CNR1CNR2
SCHEMBL18784597 0.87 ALDH1A1 (0.42) ALDH1A1CNR1CNR2TRPV1
SCHEMBL18784335 0.87 ALDH1A1 (0.42) ALDH1A1CNR1CNR2TRPV1
SCHEMBL18784338 0.87 ALDH1A1 (0.42) ALDH1A1CNR1CNR2TRPV1
SCHEMBL18800953 0.87 ALDH1A1 (0.42) ALDH1A1CNR1CNR2TRPV1
SCHEMBL18784264 0.87 ALDH1A1 (0.42) ALDH1A1CNR1CNR2TRPV1
SCHEMBL18800952 0.85 TRPV1 (0.41) ALDH1A1CNR1CNR2TRPV1
SCHEMBL22423634 0.83 ALDH1A1 (0.36) ALDH1A1
SCHEMBL20714697 0.82 LPAR1 (0.35)
SCHEMBL18784303 0.81 ALDH1A1 (0.42) ALDH1A1CNR1CNR2

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
EP-3162794-B1 ALKYL SUBSTITUTED AZETIDINES AS CATIONIC LIPID KYOWA KIRIN CO LTD (JP) 2020-09-16 EP disclosed
EP-3162794-A1 CATIONIC LIPID Kyowa Hakko Kirin Co., Ltd. (JP) 2017-05-03 EP disclosed