SCHEMBL7880781

SCHEMBL7880781

CCCOc1c(CN)cccc1Nc1cc(C)ccn1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 7/20 0.43
NPC1 O15118 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK10 P53779 4/20 0.39
JAK2 O60674 1/20 0.37
KDR P35968 1/20 0.37
NOS2 P35228 1/20 0.36
TYK2 P29597 1/20 0.36
MAPK8 P45983 1/20 0.36

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
SCHEMBL7872415 0.90 MAPK10 (0.46) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL7883207 0.86 NPC1 (0.47) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL7880201 0.83 KARS1 (0.43) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL7878698 0.81 KARS1 (0.49) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL27524202 0.80 KARS1 (0.48) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL7880192 0.80 KARS1 (0.48) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL27523583 0.77 KARS1 (0.46) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL7878572 0.76 KARS1 (0.50) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL27839436 0.71 KARS1 (0.47) KARS1NPC1MEN1KMT2AMAPK10
SCHEMBL7883213 0.71 LMNA (0.44) KARS1NPC1MEN1KMT2AMAPK10

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
US-6331553-B1 INHIBITORS OF NITRIC OXIDE SYNTHASE; TREATING CEREBROVASCULAR DISEASES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-12-18 US claimed
EP-0949242-A1 AROMATIC AMINE DERIVATIVES HAVING NOS INHIBITORY EFFECT Chugai Seiyaku Kabushiki Kaisha (JP) 1999-10-13 EP claimed
US-6331553-B1 INHIBITORS OF NITRIC OXIDE SYNTHASE; TREATING CEREBROVASCULAR DISEASES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-12-18 US disclosed
EP-0949242-A1 AROMATIC AMINE DERIVATIVES HAVING NOS INHIBITORY EFFECT Chugai Seiyaku Kabushiki Kaisha (JP) 1999-10-13 EP disclosed