SCHEMBL6992548

SCHEMBL6992548

O=C1Cc2c[c]cc3c2N1CCC3

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.50
TTR P02766 1/20 0.50
MAPT P10636 2/20 0.45
KMT2A Q03164 1/20 0.44
LMNA P02545 2/20 0.43
RAB9A P51151 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
GAA P10253 1/20 0.40

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
SCHEMBL6989332 0.95 NPC1 (0.46) NPC1TTRMAPTKMT2ALMNA
SCHEMBL6990481 0.87 CYP11B1 (0.48) KMT2A
SCHEMBL988203 0.76 CES1 (0.56) NPC1TTRMAPTKMT2ALMNA
SCHEMBL6986853 0.76 CYP11B1 (0.50) KMT2ATDP1
SCHEMBL29876793 0.75 NPC1 (0.57) NPC1TTRMAPTKMT2ALMNA
SCHEMBL11717588 0.75 NPC1 (0.57) NPC1TTRMAPTKMT2ALMNA
SCHEMBL11714046 0.75 NPC1 (0.57) NPC1TTRMAPTKMT2ALMNA
SCHEMBL11714271 0.75 NPC1 (0.61) NPC1TTRMAPTKMT2ALMNA
SCHEMBL9560034 0.71 CES1 (0.50) NPC1TTRMAPTKMT2ALMNA
SCHEMBL29876747 0.70 NPC1 (0.68) NPC1TTRMAPTKMT2ALMNA

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
EP-0607864-B1 Tricyclic condensed heterocyclic compounds for the treatment of senile dementic TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-17 EP claimed
US-5527800-A A 4H-PYRROLO(3,2,1-IJ)QUINOLIN-8-YL DERIVATIVE ADMINISTERED FOR THERAPY OR PROPHYLAXIS OF SENILE DEMENTIA TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-06-18 US claimed
EP-0607864-A2 Tricyclic condensed heterocyclic compounds for the treatment of senile dementic Takeda Chemical Industries, Ltd. (JP) 1994-07-27 EP claimed
EP-0607864-B1 Tricyclic condensed heterocyclic compounds for the treatment of senile dementic TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-17 EP disclosed