SCHEMBL10694495

SCHEMBL10694495

C=CCNc1cccc(-c2ccc3nncn3n2)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.54
▸ GAA P10253 2/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ ALDH1A1 P00352 5/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.52
▸ MAPT P10636 2/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ HTT P42858 1/20 0.51

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
SCHEMBL25060954 0.75 SMN1; SMN2 (0.60) POLBGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL10391047 0.75 POLB (0.76) POLBGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL10389914 0.74 SMN1; SMN2 (0.71) POLBGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL14134481 0.73 L3MBTL1 (0.63) POLBGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5806164 0.73 TDP1 (0.54) POLBGAASMN1; SMN2ALDH1A1MAPK1
SCHEMBL11629762 0.72 ALDH1A1 (0.56) POLBGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL11626357 0.72 SMN1; SMN2 (0.57) POLBSMN1; SMN2ALDH1A1LMNAMAPK1
SCHEMBL11642806 0.72 POLB (0.54) POLBGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL10389609 0.72 ALDH1A1 (0.50) POLBGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL10389641 0.70 ALDH1A1 (0.47) POLBGAASMN1; SMN2ALDH1A1LMNA

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-4767765-A ANXIOLYTIC OR ANTIEPILEPTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1988-08-30 — — US disclosed
EP-0223974-A1 N-Substituted-N-[3-(1,2,4-triazolo[4,3-b]pyridazin-6-yl)-phenyl]alkanamides, carbamates and ureas AMERICAN CYANAMID COMPANY (US) 1987-06-03 — — EP disclosed
US-4654343-A USEFUL AS ANXIOLYTIC OR ANTIEPILEPTIC AGENTS AS WELL AS SEDATIVE-HYPNOTIC AND SKELETAL MUSCLE RELAXANT AGENTS AMERICAN CYANAMID COMPANY (US) 1987-03-31 — — US disclosed
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