SCHEMBL19673967

SCHEMBL19673967

NN1Cc2ccccc2S1(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 12/20 0.44
▸ FFAR1 O14842 7/20 0.44
▸ PER2 O15055 1/20 0.40
▸ CRY1 Q16526 1/20 0.40
▸ CRY2 Q49AN0 1/20 0.40
▸ CACNA1H O95180 2/20 0.36
▸ KCNH2 Q12809 1/20 0.35
▸ ADAM17 P78536 1/20 0.35
▸ RAB9A P51151 1/20 0.34

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
SCHEMBL8157650 0.75 BRD4 (0.50) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL28194834 0.75 FFAR4 (0.44) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL28207011 0.75 FFAR4 (0.44) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL7364259 0.73 CACNA1H (0.41) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL23732663 0.72 FFAR4 (0.45) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL9255195 0.72 CACNA1H (0.43) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL26048164 0.72 FFAR4 (0.42) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL23733163 0.72 FFAR4 (0.42) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL3587960 0.72 FFAR4 (0.42) FFAR4FFAR1PER2CRY1CRY2
SCHEMBL26048252 0.72 FFAR4 (0.42) FFAR4FFAR1PER2CRY1CRY2

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-2768822-B1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARM SPA (IT) 2017-12-06 — — EP disclosed
Send feedback