SCHEMBL7880825

SCHEMBL7880825

CCOc1c(Nc2cc(C)ccn2)ccc(Cl)c1CN

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 5/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
PKM P14618 1/20 0.41
MAPK10 P53779 1/20 0.39
KARS1 Q15046 3/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 3/20 0.36
GLA P06280 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35
HTT P42858 1/20 0.35
SORT1 Q99523 1/20 0.34
HPGD P15428 1/20 0.34
NOS2 P35228 1/20 0.34

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
SCHEMBL7883213 0.88 LMNA (0.44) LMNASMN1; SMN2NPC1RAB9APKM
SCHEMBL7872415 0.78 MAPK10 (0.46) LMNASMN1; SMN2NPC1RAB9APKM
SCHEMBL7872384 0.69 KARS1 (0.43) LMNASMN1; SMN2NPC1RAB9AKARS1
SCHEMBL27524202 0.69 KARS1 (0.48) NPC1MAPK10KARS1ALDH1A1KMT2A
SCHEMBL7880192 0.69 KARS1 (0.48) NPC1MAPK10KARS1POLBKMT2A
SCHEMBL7883207 0.69 NPC1 (0.47) NPC1MAPK10KARS1GLAKMT2A
SCHEMBL7880781 0.69 KARS1 (0.43) NPC1MAPK10KARS1KMT2AMEN1
SCHEMBL27839436 0.69 KARS1 (0.47) NPC1RAB9AMAPK10KARS1ALDH1A1
SCHEMBL7872421 0.67 LMNA (0.47) LMNASMN1; SMN2NPC1RAB9APKM
SCHEMBL7880201 0.67 KARS1 (0.43) NPC1MAPK10KARS1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1244542-C Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2006-03-08 CN claimed
US-6331553-B1 INHIBITORS OF NITRIC OXIDE SYNTHASE; TREATING CEREBROVASCULAR DISEASES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-12-18 US claimed
CN-1240419-A Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2000-01-05 CN claimed
EP-0949242-A1 AROMATIC AMINE DERIVATIVES HAVING NOS INHIBITORY EFFECT Chugai Seiyaku Kabushiki Kaisha (JP) 1999-10-13 EP claimed
CN-1244542-C Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2006-03-08 CN disclosed
US-6331553-B1 INHIBITORS OF NITRIC OXIDE SYNTHASE; TREATING CEREBROVASCULAR DISEASES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-12-18 US disclosed
CN-1240419-A Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2000-01-05 CN disclosed
EP-0949242-A1 AROMATIC AMINE DERIVATIVES HAVING NOS INHIBITORY EFFECT Chugai Seiyaku Kabushiki Kaisha (JP) 1999-10-13 EP disclosed