SCHEMBL21240017

SCHEMBL21240017

CCCCCCCC/C=C\CCCCCCCC[N+](C)(CC)CC

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.50
TRPV1 Q8NER1 1/20 0.50
DNM1 Q05193 10/20 0.48
HTT P42858 2/20 0.48
KMT2A Q03164 1/20 0.48
HSP90AA1 P07900 1/20 0.46
RAD52 P43351 1/20 0.46

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
Hydrochloric Acid SCHEMBL9814063 0.98 FAAH (0.48) FAAHTRPV1DNM1HTTKMT2A
Hydrochloric Acid SCHEMBL9814060 0.98 FAAH (0.48) FAAHTRPV1DNM1HTTKMT2A
SCHEMBL8652742 0.91 FAAH (0.54) FAAHTRPV1DNM1HTT
Hydrochloric Acid SCHEMBL2044456 0.89 DNM1 (0.52) FAAHTRPV1DNM1HTT
Hydrochloric Acid SCHEMBL2043713 0.89 DNM1 (0.52) FAAHTRPV1DNM1HTT
Hydrochloric Acid SCHEMBL2047104 0.89 DNM1 (0.52) FAAHTRPV1DNM1HTT
SCHEMBL2336593 0.86 DNM1 (0.62) DNM1HTTKMT2AHSP90AA1RAD52
SCHEMBL12581521 0.86 DNM1 (0.62) DNM1HTTKMT2AHSP90AA1RAD52
SCHEMBL1237102 0.86 DNM1 (0.62) DNM1HTTKMT2AHSP90AA1RAD52
SCHEMBL4268587 0.86 DNM1 (0.62) DNM1HTTKMT2AHSP90AA1RAD52

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-20200048508-A1 SILICONE COMPOSITION FOR RELEASE PAPER OR RELEASE FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-02-13 US disclosed
EP-3524655-A1 SILICONE COMPOSITION FOR RELEASE PAPER OR RELEASE FILM Shin-Etsu Chemical Co., Ltd. (JP) 2019-08-14 EP disclosed