SCHEMBL30973183

SCHEMBL30973183

Cc1ccc(C2NCCc3ccccc32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRCP P42785 6/20 1.00
GAA P10253 1/20 0.72
GID4 Q8IVV7 2/20 0.69
RECQL P46063 1/20 0.66
KDM1A O60341 3/20 0.60
OPRM1 P35372 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL28277290 1.00 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL22728763 1.00 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL7214001 1.00 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL325083 0.85 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL12046710 0.85 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL1668148 0.85 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL30721685 0.85 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL327233 0.85 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
SCHEMBL29478499 0.85 PRCP (1.00) PRCPGAAGID4RECQLKDM1A
Hydrochloric Acid SCHEMBL1735508 0.84 GAA (1.00) PRCPGAAGID4RECQLKDM1A

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
CN-118146154-A Method for synergistic catalysis of selective oxidative dehydrogenation of tetrahydroisoquinoline 西安石油大学 2024-06-07 CN disclosed