SCHEMBL7900117

SCHEMBL7900117

CCCCCCCCCCCCNC(=S)Nc1ccncc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
KMT2A Q03164 6/20 0.58
HTT P42858 5/20 0.58
MEN1 O00255 3/20 0.58
NAAA Q02083 1/20 0.55
ALDH1A1 P00352 4/20 0.52
MAPT P10636 3/20 0.52
GAA P10253 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
PABPC1 P11940 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
QPCT Q16769 1/20 0.49

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
SCHEMBL7966915 0.92 CA9 (0.54) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL28223385 0.84 KMT2A (0.75) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL5445981 0.84 KMT2A (0.75) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL10667599 0.84 KMT2A (0.75) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL5447975 0.84 KMT2A (0.75) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL5446742 0.84 KMT2A (0.75) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL5445779 0.84 KMT2A (0.75) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL11068116 0.84 KMT2A (0.75) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL8438232 0.83 LMNA (0.65) LMNASMN1; SMN2KMT2AHTTMEN1
SCHEMBL8443237 0.83 LMNA (0.65) LMNASMN1; SMN2KMT2AHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197797-B1 ANTICANCER AGENTS; SKIN DISORDERS Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 2001-03-06 US disclosed
EP-0984939-A1 CYANOGUANIDINES AS CELL PROLIFERATION INHIBITORS LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2000-03-15 EP disclosed
WO-1998054145-A1 CYANOGUANIDINES AS CELL PROLIFERATION INHIBITORS Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 1998-12-03 WO disclosed