SCHEMBL5130355

SCHEMBL5130355

Cc1nc(NC(CO)Cc2ccco2)ccc1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.40
TXNRD1 Q16881 1/20 0.40
MIF P14174 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 6/20 0.37
POLB P06746 2/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
CRHBP P24387 2/20 0.35
CRHR2 Q13324 2/20 0.35
GAA P10253 2/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR6 P50406 1/20 0.35
BLM P54132 1/20 0.35
L3MBTL1 Q9Y468 1/20 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
SCHEMBL5130347 1.00 HPGD (0.40) HPGDTXNRD1MIFALDH1A1MEN1
SCHEMBL5972133 0.85 TXNRD1 (0.42) HPGDTXNRD1MIFALDH1A1MEN1
SCHEMBL5123860 0.82 MAPT (0.45) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL5123863 0.82 MAPT (0.45) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL5126008 0.80 MAPT (0.51) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL5126018 0.80 MAPT (0.51) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL5122458 0.78 ENPP2 (0.48) HPGDTXNRD1ALDH1A1MEN1KMT2A
SCHEMBL5126001 0.75 MAPT (0.39) TXNRD1ALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL5120760 0.75 MAPT (0.39) HPGDALDH1A1MAPTPOLBHTT
SCHEMBL5120767 0.75 MAPT (0.39) HPGDALDH1A1MAPTPOLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685090-A1 ANDROGEN RECEPTOR MODULATORS KARO BIO AB (SE) 2006-08-02 EP claimed
WO-2005042464-A1 ANDROGEN RECEPTOR MODULATORS KARO BIO AB (SE) 2005-05-12 WO claimed
US-20080058383-A1 Androgen Receptor Modulators KARO BIO AB (SE) 2008-03-06 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-20080058383-A1 Androgen Receptor Modulators NR5A1, ESRRA, AR HPGD 326/4885TXNRD1 562/4885MIF 3526/4885

“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.