SCHEMBL8045009

SCHEMBL8045009

Cc1cc(N[C@@H](C)c2ccc(F)cc2)nnc1Cl

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 5/20 0.45
▸ PSEN2 P49810 5/20 0.45
▸ APH1B Q8WW43 5/20 0.45
▸ NCSTN Q92542 5/20 0.45
▸ APH1A Q96BI3 5/20 0.45
▸ PSENEN Q9NZ42 5/20 0.45
▸ GPR55 Q9Y2T6 13/20 0.45
▸ NTRK1 P04629 1/20 0.41
▸ CCNT1 O60563 1/20 0.38
▸ CDK9 P50750 1/20 0.38

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
SCHEMBL8051390 0.77 GPR55 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20575147 0.75 HTR7 (0.53) GPR55NTRK1
SCHEMBL20575148 0.75 HTR7 (0.53) GPR55NTRK1
SCHEMBL1366564 0.73 GPR55 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8058012 0.73 PSEN1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1366562 0.73 GPR55 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1365910 0.72 NTRK1 (0.47) GPR55NTRK1CCNT1CDK9
SCHEMBL1365913 0.72 NTRK1 (0.47) GPR55NTRK1CCNT1CDK9
SCHEMBL1367667 0.70 GPR55 (0.46) GPR55NTRK1
SCHEMBL1367669 0.70 GPR55 (0.46) GPR55NTRK1

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
WO-2009050227-A1 PYRIDAZINE DERIVATIVES FOR INHIBITING BETA AMYLOID PEPTIDE PRODUCTION GLAXO GROUP LIMITED (GB) 2009-04-23 — — WO disclosed
Send feedback