SCHEMBL10923793

SCHEMBL10923793

CC1=NC(=O)N=C1C(=S)Nc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ POLB P06746 1/20 0.44
▸ LMNA P02545 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.38
▸ NOX1 Q9Y5S8 1/20 0.38

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
SCHEMBL9786587 0.67 MAPT (0.50) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL11738124 0.65 MEN1 (0.62) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL10099725 0.64 GAA (0.83) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL4737020 0.63 MAOB (0.51) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL28901021 0.63 NPC1 (0.67) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL935849 0.62 ALDH1A1 (0.64) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL6302055 0.62 GAA (0.64) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL9786648 0.61 LMNA (0.42) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL2615418 0.61 KMT2A (0.81) KMT2AMEN1POLBLMNASMN1; SMN2
SCHEMBL20560273 0.61 GAA (0.57) KMT2AMEN1POLBLMNASMN1; SMN2

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-0078546-B1 NOVEL IMIDAZOLECARBOXAMIDE DERIVATIVES MERRELL DOW PHARMACEUTICALS INC. (US) 1986-11-12 — — EP disclosed
EP-0078546-A1 Novel imidazolecarboxamide derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1983-05-11 — — EP disclosed
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