SCHEMBL3273746

SCHEMBL3273746

CCOC(=O)C1CCCC(c2ccc(Cl)cc2Cl)C1=O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.51
LMNA P02545 3/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TP53 P04637 2/20 0.48
TLR4 O00206 1/20 0.46
DPP4 P27487 1/20 0.46
TSHR P16473 3/20 0.43
HTT P42858 2/20 0.42
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 1/20 0.40
RECQL P46063 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL513682 0.81 GPBAR1 (0.48) MAPK1LMNAMAPTMEN1KMT2A
SCHEMBL5489867 0.79 TP53 (0.45) MAPK1MEN1KMT2ATP53TSHR
SCHEMBL512462 0.78 TSHR (0.50) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL7027734 0.78 TP53 (0.44) MAPK1MEN1KMT2ATP53TSHR
SCHEMBL3081279 0.76 LMNA (0.47) LMNAMAPTMEN1KMT2ATP53
SCHEMBL4077853 0.74 TLR4 (0.55) LMNAMAPTMEN1KMT2ATLR4
SCHEMBL5896950 0.72 TLR4 (0.49) MAPTMEN1KMT2ATP53TLR4
SCHEMBL880464 0.71 TP53 (0.76) MAPK1LMNAMAPTMEN1KMT2A
SCHEMBL2191332 0.69 HTT (0.49) MAPK1LMNAMAPTMEN1KMT2A
SCHEMBL23088507 0.69 MEN1 (0.52) MAPK1LMNAMAPTMEN1KMT2A

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 6 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-7279474-B2 Substituted pyrrolo[2,3-d]pyrimidines as antagonists of the corticotropin releasing factor (CRF) GLAXO GROUP LIMITED (GB) 2007-10-09 US 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
EP-1618107-A1 CONDENSED N-HETEROCYCLIC COMPOUNDS AND THEIR USE AS CRF RECEPTOR ANTAGONISTS SB Pharmco Puerto Rico Inc (US) 2006-01-25 EP disclosed
WO-2004094419-A1 CONDENSED N-HETEROCYCLIC COMPOUNDS AND THEIR USE AS CRF RECEPTOR ANTAGONISTS SB PHARMCO PUERTO RICO INC (US) 2004-11-04 WO disclosed
US-20040176400-A1 Fused pyrimidines as antagonists of the corticotropin releasing factor (crf) GLAXO GROUP LIMITED (GB) 2004-09-09 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 (2 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 MAPK1 1825/4885LMNA 1696/4885MAPT 4761/4885
US-20040176400-A1 Fused pyrimidines as antagonists of the corticotropin releasing factor (crf) CRH, CRHR1, CRHR2 MAPK1 1991/4885LMNA 4763/4885MAPT 3273/4885

“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.