SCHEMBL900695

SCHEMBL900695

C[CH]Cc1ccc(C)c(C)c1C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 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
SCHEMBL1612425 0.79
SCHEMBL9279152 0.79 TDP2 (0.32)
SCHEMBL11759870 0.79 GABRA1 (0.36) SMN1; SMN2
SCHEMBL8436160 0.77 CYP1A2 (0.32)
SCHEMBL1612120 0.76
SCHEMBL9839922 0.74 TAAR1 (0.34)
SCHEMBL900990 0.73 CYP1A2 (0.30)
SCHEMBL31095112 0.72 TDP2 (0.37) SMN1; SMN2
SCHEMBL598503 0.72 TDP2 (0.37) SMN1; SMN2
SCHEMBL16986772 0.71 P2RX7 (0.31)

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
EP-2621922-A1 A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS BASF SE (DE) 2013-08-07 EP disclosed
WO-2012041858-A1 A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS BASF SE (DE) 2012-04-05 WO disclosed