SCHEMBL4783607

SCHEMBL4783607

NC(c1ncco1)c1n[nH]c2ccc([N+](=O)[O-])cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
HPGD P15428 1/20 0.48
CNR2 P34972 3/20 0.40
CNR1 P21554 2/20 0.39
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA2 P47869 1/20 0.38
CDK2 P24941 1/20 0.38
CLK1 P49759 2/20 0.37
POLB P06746 1/20 0.36
MAOB P27338 1/20 0.36
NOS1 P29475 1/20 0.36
CSNK2A1 P68400 1/20 0.36
CDK5 Q00535 2/20 0.35
CDK5R1 Q15078 1/20 0.35
MEN1 O00255 2/20 0.35

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
SCHEMBL4782643 0.77 MAPT (0.48) MAPTHPGDCNR2CNR1CA12
SCHEMBL4783909 0.76 MAPT (0.61) MAPTHPGDCNR2CNR1CA12
SCHEMBL18113557 0.73 MAPT (0.57) MAPTHPGDCNR2CNR1CA12
SCHEMBL3374982 0.73 MAPT (0.57) MAPTHPGDCNR2CNR1CA12
SCHEMBL31423204 0.73 MAPT (0.57) MAPTHPGDCNR2CNR1CA12
SCHEMBL27771844 0.71 MAPT (0.55) MAPTHPGDCNR2CNR1CA12
SCHEMBL757425 0.70 MAPT (0.63) MAPTHPGDCNR2CNR1CA12
SCHEMBL4783616 0.70 CDK2 (0.48) MAPTHPGDCNR2CNR1CA12
SCHEMBL12193486 0.67 MAPT (0.63) MAPTHPGDCNR2CNR1CA12
SCHEMBL16025479 0.67 MAPT (0.67) MAPTHPGDCNR2CNR1CA12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US disclosed
WO-2008061109-A2 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS MCHR1, MCHR2, MC1R MAPT 1651/4885HPGD 730/4885CNR2 266/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.