SCHEMBL6979656

SCHEMBL6979656

[CH2]CCc1ccc2c(c1)OOC2

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.33
▸ CHRM2 P08172 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ CHRNB2 P17787 1/20 0.30
▸ CHRM3 P20309 1/20 0.30
▸ CHRNA4 P43681 1/20 0.30

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
SCHEMBL9669770 0.85 CYP1A2 (0.30) —
SCHEMBL9752268 0.82 TDP1 (0.33) TAAR1CHRM2CHRM1CHRNB2CHRM3
SCHEMBL3023634 0.80 CHRM2 (0.35) CHRM2CHRM1CHRNB2CHRM3CHRNA4
SCHEMBL8950647 0.78 MAPT (0.45) TAAR1CHRM2CHRM1CHRM3
SCHEMBL7074719 0.78 TAAR1 (0.34) TAAR1
SCHEMBL1486243 0.78 CMA1 (0.32) TAAR1CHRM2CHRM1CHRNB2CHRM3
SCHEMBL6853638 0.78 CA12 (0.33) —
SCHEMBL6203463 0.77 IDO1 (0.42) —
SCHEMBL7835653 0.77 FFAR1 (0.43) —
Hydrochloric Acid SCHEMBL7235293 0.76 IDO1 (0.43) —

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-0892795-B1 PIPERIDINYLPYRAMIDINE DERIVATIVES SUMITOMO PHARMA (JP) 2003-01-08 — — EP disclosed
Send feedback