SCHEMBL5842971

SCHEMBL5842971

Cc1cc(C)c(Cc2nc(C)nc(O)c2C)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.37
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
CRHR1 P34998 4/20 0.32
TP53 P04637 1/20 0.31
ACHE P22303 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 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
SCHEMBL5843498 0.79 HTR1D (0.36) XIAPHTR1DHTR1BMAPTKDM4E
SCHEMBL27486352 0.76
SCHEMBL5843330 0.71 CRHR1 (0.50) CRHR1
SCHEMBL1316919 0.67 HTR1D (0.48) XIAPHTR1DHTR1BMAPTKDM4E
SCHEMBL16904621 0.66 ALDH1A1 (0.50) HTR1DHTR1BMAPTKDM4EALDH1A1
SCHEMBL276022 0.65
SCHEMBL69436 0.62 SELL (0.48) HTR1DHTR1BMAPTKDM4EALDH1A1
SCHEMBL28637900 0.62 SHBG (0.48) HTR1DHTR1BMAPTKDM4EALDH1A1
SCHEMBL15799777 0.61 THRB (0.57) MAPTKDM4EALDH1A1GAAACHE
SCHEMBL4864496 0.60 HTR1D (0.42) HTR1DHTR1BALDH1A1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125880-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2006-10-24 US disclosed
US-7067664-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2006-06-27 US disclosed
US-6956047-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2005-10-18 US disclosed
US-20050032846-A1 Corticotropin releasing factor antagonists PFIZER INC. 2005-02-10 US disclosed
US-6844351-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2005-01-18 US disclosed
EP-0764166-B1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER (US) 2000-09-13 EP disclosed
US-5962479-A Corticotropin releasing factor antagonists PFIZER INC. (US) 1999-10-05 US disclosed
EP-0764166-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER INC. (US) 1997-03-26 EP disclosed
WO-1995033750-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER INC. (US) 1995-12-14 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-20050032846-A1 Corticotropin releasing factor antagonists CRH, CRHR2, CRHR1 XIAP 4116/4885HTR1D 259/4885HTR1B 94/4885

“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.