SCHEMBL7140932

SCHEMBL7140932

O=C1Nc2ccc(CCCl)cc2C1=Cc1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 7/20 0.62
PSEN2 P49810 7/20 0.62
APH1B Q8WW43 7/20 0.62
NCSTN Q92542 7/20 0.62
APH1A Q96BI3 7/20 0.62
PSENEN Q9NZ42 7/20 0.62
LRRK2 Q5S007 9/20 0.61
FLT3 P36888 1/20 0.50

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
SCHEMBL7137564 0.89 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7133824 0.89 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5361803 0.88 LRRK2 (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7139415 0.88 EGFR (0.60) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7136387 0.88 PSEN1 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7136650 0.88 LRRK2 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7133803 0.86 LRRK2 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7134346 0.86 RAF1 (0.57) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5362836 0.85 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7139546 0.85 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 US disclosed