SCHEMBL9359306

SCHEMBL9359306

N#Cc1cccc(C2=CCC(=S)C=C2)c1C#N

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.30
HIF1A Q16665 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
SCHEMBL10629422 0.86 ESR2 (0.39)
SCHEMBL9360804 0.78
SCHEMBL9360915 0.72 KDM4E (0.37) SMN1; SMN2
SCHEMBL11132592 0.72 ESR2 (0.43) SMN1; SMN2HIF1A
SCHEMBL11876478 0.67 ESR2 (0.48) SMN1; SMN2HIF1A
SCHEMBL820505 0.67 ESR2 (0.48) SMN1; SMN2HIF1A
SCHEMBL645262 0.65 TSHR (0.48) SMN1; SMN2HIF1A
SCHEMBL769515 0.64 SMN1; SMN2 (0.51) SMN1; SMN2HIF1A
SCHEMBL30359283 0.64 SMN1; SMN2 (0.51) SMN1; SMN2HIF1A
Bicarbonate SCHEMBL11598084 0.64 ESR2 (0.41) SMN1; SMN2HIF1A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5346670-A Phthalocyanine and tetrabenztriazaporphyrin reagents BRITISH TECHNOLOGY GROUP U.S.A. INC. (US) 1994-09-13 US disclosed
EP-0434727-A4 RED-SHIFTED PHTHALOCYANINE AND TETRABENZTRIAZAPORPHYRIN REAGENTS ULTRA DIAGNOSTIC CORP (US) 1994-08-17 EP disclosed
US-5135717-A Imaging therapy BRITISH TECHNOLOGY GROUP USA INC. (US) 1992-08-04 US disclosed
EP-0434727-A1 RED-SHIFTED PHTHALOCYANINE AND TETRABENZTRIAZAPORPHYRIN REAGENTS BRITISH TECHNOLOGY GROUP (USA) INCORPORATED (US) 1991-07-03 EP disclosed
WO-1990002747-A1 RED-SHIFTED PHTHALOCYANINE AND TETRABENZTRIAZAPORPHYRIN REAGENTS ULTRA DIAGNOSTICS CORPORATION (US) 1990-03-22 WO disclosed