SCHEMBL3699136

SCHEMBL3699136

O=C(c1nc2ccccc2nc1O)N1CCCCC1Cc1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.56
HCRTR1 O43613 13/20 0.48
HCRTR2 O43614 13/20 0.48
CYP3A4 P08684 3/20 0.48
SCD5 Q86SK9 1/20 0.43
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
TACR1 P25103 1/20 0.41
F2 P00734 2/20 0.41

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
SCHEMBL3699134 1.00 FABP4 (0.56) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL3702050 1.00 FABP4 (0.56) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL3693099 0.97 FABP4 (0.59) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL3693103 0.97 FABP4 (0.59) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL3693140 0.97 FABP4 (0.59) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL6988513 0.91 FABP4 (0.55) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL6988153 0.91 FABP4 (0.55) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL6987923 0.90 FABP4 (0.58) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL3700719 0.89 FABP4 (0.59) FABP4HCRTR1HCRTR2CYP3A4SCD5
SCHEMBL3700092 0.89 FABP4 (0.67) FABP4HCRTR1HCRTR2CYP3A4SCD5

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-8889683-B2 Substituted quinoxalines as inhibitors of fatty acid binding protein MERCK SHARP & DOHME CORP. (US) 2014-11-18 US disclosed
US-20120122837-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN MERCK SHARP & DOHME LLC 2012-05-17 US 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-20120122837-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN FABP4, FABP1, FABP3 FABP4 1/4885HCRTR1 4346/4885HCRTR2 3592/4885

“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.