SCHEMBL5235907

SCHEMBL5235907

CNC1(CC=O)CN(c2ccc3cnc(Cl)cc3c2)CCN1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.35
DYRK1A Q13627 4/20 0.33
WNT1 P04628 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
ENPP2 Q13822 1/20 0.31
GSK3B P49841 1/20 0.31

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
SCHEMBL5232312 0.84 ABL1 (0.32) ABL1DYRK1AWNT1TRPV1
SCHEMBL5235809 0.82 MAPT (0.44)
SCHEMBL5239098 0.81 MEN1 (0.39)
SCHEMBL5235901 0.81 ABL1 (0.37) ABL1DYRK1AWNT1TRPV1GSK3B
SCHEMBL5236743 0.80 ALDH1A1 (0.45)
SCHEMBL5236419 0.80 ADAMTS5 (0.39)
SCHEMBL5233364 0.79 MAPT (0.39)
SCHEMBL5231485 0.79 HTR3A (0.44) TRPV1
SCHEMBL5236354 0.79 CHRNB2 (0.38)
SCHEMBL5235446 0.78 ALDH1A1 (0.37)

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
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed