SCHEMBL10690142

SCHEMBL10690142

CC(=O)c1c(C)nc2c3cccc(Cl)c3ccn12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 5/20 0.47
RAB9A P51151 3/20 0.47
HCRTR1 O43613 1/20 0.47
TP53 P04637 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 2/20 0.47
NOTUM Q6P988 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
EPHB3 P54753 2/20 0.38
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 1/20 0.36
KLKB1 P03952 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
SCHEMBL10690311 0.89 SMN1; SMN2 (0.47) ALDH1A1MAPTSMN1; SMN2RAB9AHCRTR1
SCHEMBL10685737 0.88 SMN1; SMN2 (0.46) ALDH1A1MAPTSMN1; SMN2RAB9AHCRTR1
Hydrochloric Acid SCHEMBL10691971 0.88 SMN1; SMN2 (0.46) ALDH1A1MAPTSMN1; SMN2RAB9AHCRTR1
SCHEMBL10690389 0.84 SMN1; SMN2 (0.70) ALDH1A1MAPTSMN1; SMN2RAB9AHCRTR1
SCHEMBL10692077 0.80 CYP1A2 (0.42) ALDH1A1MAPTSMN1; SMN2RAB9AHCRTR1
SCHEMBL10687438 0.78 MAPK1 (0.39) MAPTSMN1; SMN2RAB9AHCRTR1TP53
SCHEMBL10689387 0.78 SMN1; SMN2 (0.42) ALDH1A1MAPTSMN1; SMN2RAB9AHCRTR1
SCHEMBL10690457 0.77 NR4A2 (0.42) MAPTSMN1; SMN2RAB9AHCRTR1TP53
SCHEMBL10693410 0.77 HCRTR1 (0.39) MAPTSMN1; SMN2RAB9AHCRTR1TP53
SCHEMBL10692304 0.77 KMT2A (0.43) ALDH1A1MAPTSMN1; SMN2RAB9AHCRTR1

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-4738967-A Imidazoisoquinoline compounds useful as anti-ulcerative agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-04-19 US disclosed
US-4686227-A Imidazoisoquinoline compounds useful as anti-ulcerative agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-08-11 US disclosed
EP-0165545-A2 Imidazoisoquinoline compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-12-27 EP disclosed