SCHEMBL11510340

SCHEMBL11510340

CCCCCCCCCCCCSc1nc[nH]n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
LMNA P02545 2/20 0.50
MAPT P10636 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
USP2 O75604 1/20 0.43
GPR84 Q9NQS5 2/20 0.43
PAK1 Q13153 1/20 0.43
GAA P10253 2/20 0.42
HTT P42858 2/20 0.42
ALPL P05186 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTGES O14684 2/20 0.40
XDH P47989 2/20 0.40
HAO1 Q9UJM8 1/20 0.40

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
SCHEMBL9836459 1.00 SMN1; SMN2 (0.50) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL9175656 1.00 SMN1; SMN2 (0.50) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL1763254 0.85
SCHEMBL17727017 0.83 SMN1; SMN2 (0.36) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL11511847 0.83 SMN1; SMN2 (0.37) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL17727034 0.80 ALDH1A1 (0.35) SMN1; SMN2LMNAMAPTALDH1A1HPGD
Bromide SCHEMBL11220167 0.76 DYRK3 (0.32) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL11367182 0.75 MEN1 (0.36) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL11375936 0.74 SMN1; SMN2 (0.38) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL11334284 0.73 SMN1; SMN2 (0.51) SMN1; SMN2LMNAMAPTALDH1A1HPGD

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
US-4178253-A 1,2,4-TRIAZOLE COMPOUNDS CIBA-GEIGY CORPORATION (US) 1979-12-11 US disclosed