SCHEMBL11249640

SCHEMBL11249640

CN1CCS/C1=N\C(=S)Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 2/20 0.53
▸ LMNA P02545 5/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ GAA P10253 5/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ MAPT P10636 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ IDO1 P14902 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL11249646 1.00 GRM5 (0.53) GRM5LMNASMN1; SMN2GAAALDH1A1
SCHEMBL11262129 0.86 GRM5 (0.53) GRM5LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL11262133 0.86 GRM5 (0.53) GRM5LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL11251301 0.82 NPSR1 (0.49) GRM5LMNASMN1; SMN2GAAALDH1A1
SCHEMBL11251303 0.82 NPSR1 (0.49) GRM5LMNASMN1; SMN2GAAALDH1A1
SCHEMBL11267827 0.81 GRM5 (0.44) GRM5LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL11267830 0.81 GRM5 (0.44) GRM5LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL11086248 0.80 GRM5 (0.52) GRM5SMN1; SMN2GAAALDH1A1MAPT
SCHEMBL11086245 0.80 GRM5 (0.52) GRM5SMN1; SMN2GAAALDH1A1MAPT
SCHEMBL11539280 0.70 CTDSP1 (0.44) GRM5SMN1; SMN2GAAALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0011963-B1 HETEROCYCLIC CARBOXAMIDINE COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1982-07-14 — — EP disclosed
US-4282356-A HYPOGLYCEMIC BEECHAM GROUP LIMITED (GB) 1981-08-04 — — US disclosed
US-4250173-A HYPOGLYCEMIC AGENTS FOR TREATMENT OF DIABETES BEECHAM GROUP LIMITED (GB) 1981-02-10 — — US disclosed
EP-0011963-A1 Heterocyclic carboxamidine compounds, their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1980-06-11 — — EP disclosed
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