SCHEMBL7433439

SCHEMBL7433439

[c]1nc(C2NCCc3ccccc32)cc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRCP P42785 8/20 0.49
RECQL P46063 1/20 0.48
GAA P10253 1/20 0.48
GID4 Q8IVV7 1/20 0.42
MAPT P10636 2/20 0.39
SLC22A1 O15245 1/20 0.38
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
KDM1A O60341 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL18686402 0.86 DRD1 (0.35) MAPTTSHR
SCHEMBL17760557 0.76 ADRA2A (0.45) GID4MEN1KMT2A
SCHEMBL5190924 0.74 PRCP (0.48) PRCPRECQLGAAGID4MAPT
SCHEMBL28547431 0.72 PRCP (0.53) PRCPRECQLGAAGID4MAPT
SCHEMBL7498131 0.71 PRCP (0.51) PRCPRECQLGAAGID4MAPT
SCHEMBL5023257 0.70 RECQL (0.59) PRCPRECQLGAAGID4MAPT
SCHEMBL7698338 0.70 RECQL (0.59) PRCPRECQLGAAGID4MAPT
SCHEMBL7702387 0.70 RECQL (0.59) PRCPRECQLGAAGID4MAPT
SCHEMBL6691603 0.70 PRCP (0.53) PRCPRECQLGAAGID4MAPT
SCHEMBL1597975 0.69 KDM1A (0.69) PRCPRECQLGAAGID4TSHR

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-0481671-A1 New substituted azetidinones as anti-inflammatory and antidegenerative agents MERCK & CO. INC. (US) 1992-04-22 EP disclosed