SCHEMBL5659535

SCHEMBL5659535

O=C(NCc1ccc(NC2=NCCN2)cc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
NAMPT P43490 13/20 0.58
HPGD P15428 1/20 0.55
MAPT P10636 1/20 0.54
LMNA P02545 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL5655412 0.91 NAMPT (0.59) ALDH1A1NAMPTSMN1; SMN2
SCHEMBL5655917 0.91 NAMPT (0.59) ALDH1A1NAMPTHPGDMAPTLMNA
SCHEMBL5656620 0.89 LMNA (0.61) ALDH1A1NAMPTMAPTLMNA
SCHEMBL5660187 0.86 ALDH1A1 (0.52) ALDH1A1NAMPTMAPTMAPK1
SCHEMBL5656488 0.85 ADRA2A (0.58) ALDH1A1NAMPTHPGDMAPK1HTT
SCHEMBL5666757 0.85 EPHX2 (0.55)
SCHEMBL5658117 0.84 ADRA2A (0.59) NAMPT
Hydrochloric Acid SCHEMBL4744226 0.84 ADRA2A (0.68) ALDH1A1MAPTLMNAMAPK1HTT
SCHEMBL5654940 0.83 ALDH1A1 (0.58) ALDH1A1NAMPTMAPTLMNAMAPK1
Hydrochloric Acid SCHEMBL5839548 0.82 ADRA2A (0.65) ALDH1A1HPGDLMNAMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279498-B2 Substituted aryl amides as IP antagonists ROCHE PALO ALTO LLC (US) 2007-10-09 US disclosed
US-7279498-B2 Substituted aryl amides as IP antagonists ROCHE PALO ALTO LLC (US) 2007-10-09 US disclosed
US-7279498-B2 Substituted aryl amides as IP antagonists ROCHE PALO ALTO LLC (US) 2007-10-09 US disclosed
US-6998414-B2 Substituted arylamides as IP antagonists ROCHE PALO ALTO LLC (US) 2006-02-14 US disclosed
US-20060004075-A1 Substituted aryl amides as IP antagonists ROCHE PALO ALTO LLC 2006-01-05 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-20060004075-A1 Substituted aryl amides as IP antagonists INSR, INSRR, GIPR ALDH1A1 2894/4885NAMPT 1589/4885HPGD 1739/4885

“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.