SCHEMBL7319215

SCHEMBL7319215

[CH2]C(C)CC/C=C/CCCC

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
FAAH O00519 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
F7 P08709 1/20 0.38
F3 P13726 1/20 0.38
CNR1 P21554 5/20 0.36

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
SCHEMBL7319223 1.00 ALDH1A1 (0.40) ALDH1A1TSHRFAAHTRPV1F7
SCHEMBL28676449 0.91 FAAH (0.50) TSHRFAAHTRPV1F7F3
SCHEMBL7296489 0.91 TSHR (0.40) ALDH1A1TSHRFAAHTRPV1F7
SCHEMBL7296491 0.91 TSHR (0.40) ALDH1A1TSHRFAAHTRPV1F7
SCHEMBL7294697 0.88 FAAH (0.41) ALDH1A1TSHRFAAHTRPV1F7
SCHEMBL7294690 0.88 FAAH (0.41) ALDH1A1TSHRFAAHTRPV1F7
SCHEMBL2119332 0.85 TSHR (0.35) TSHR
SCHEMBL2119328 0.85 TSHR (0.35) TSHR
SCHEMBL6949363 0.82 FAAH (0.50) TSHRFAAHTRPV1F7F3
SCHEMBL6949367 0.82 FAAH (0.50) TSHRFAAHTRPV1F7F3

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-0202760-A2 Carbostyril derivatives and salts thereof, processes for preparing the same and cardiotonic composition containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-11-26 EP disclosed