SCHEMBL3271973

SCHEMBL3271973

C=CCc1c(Cl)nc(C)nc1N(C(=O)O)c1ccc(Cl)c(C(C)(C)C)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
RXRA P19793 2/20 0.32
NR4A2 P43354 2/20 0.32
CRHR1 P34998 1/20 0.30

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
SCHEMBL5572275 0.91
SCHEMBL3273515 0.85
SCHEMBL3929768 0.81 RXRA (0.30) RXRANR4A2
SCHEMBL3271971 0.73 RXRA (0.33) ALDH1A1RXRANR4A2
SCHEMBL3271020 0.72 FSCN1 (0.36)
SCHEMBL4172029 0.70 RXRA (0.32) RXRA
SCHEMBL5489054 0.70 LMNA (0.33) ALDH1A1RXRANR4A2
SCHEMBL3277335 0.68 KMT2A (0.34) ALDH1A1CRHR1
SCHEMBL3277343 0.68 KMT2A (0.34) ALDH1A1CRHR1
SCHEMBL3930718 0.67

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
EP-1618107-B1 CONDENSED N-HETEROCYCLIC COMPOUNDS AND THEIR USE AS CRF RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORK LTD (IE) 2010-06-30 EP disclosed
US-20070021429-A1 Condensed n-heterocyclic compounds and their use as crf receptor antagonists SMITHKLINE BEECHAM (CORK) LIMITED (IE) 2007-01-25 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-20070021429-A1 Condensed n-heterocyclic compounds and their use as crf receptor antagonists CRHR1, NR3C2, CRHR2 ALDH1A1 3578/4885RXRA 640/4885NR4A2 23/4885

“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.