SCHEMBL10049792

SCHEMBL10049792

BC1CCc2cccc(Br)c2N1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PNMT P11086 1/20 0.32
▸ PDE7A Q13946 1/20 0.31
▸ IDO1 P14902 1/20 0.30
▸ PDPK1 O15530 1/20 0.30

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
SCHEMBL10049491 0.80 PDE7A (0.37) PDE7A
SCHEMBL10049492 0.72 MTNR1A (0.35) PDE7A
SCHEMBL2321700 0.69 LMNA (0.36) —
SCHEMBL21676033 0.69 DRD1 (0.43) IDO1PDPK1
SCHEMBL652655 0.67 PARP10 (0.43) PNMTPDE7APDPK1
SCHEMBL6796232 0.64 SRC (0.49) PNMTPDE7A
Hydrochloric Acid SCHEMBL21598450 0.63 SRC (0.47) PNMTPDE7A
SCHEMBL6090116 0.63 NPC1 (0.50) PDE7A
SCHEMBL31402653 0.62 P2RX7 (0.35) —
SCHEMBL10840441 0.61 PDE7A (0.37) PDE7A

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-2012009369-A1 CATALYSTS BASED ON QUINOLINE PRECURSORS BASELL POLYOLEFINE GMBG (DE) 2012-01-19 — — WO disclosed
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