SCHEMBL5844244

SCHEMBL5844244

CCOC(=O)Cc1c(Cl)nc(C)nc1NC(CC)CC

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.40
KDM4E B2RXH2 5/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 3/20 0.35
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
HTR6 P50406 1/20 0.35
TDP1 Q9NUW8 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL5844147 0.81 MAPK1 (0.46) KDM4ELMNAMAPK1HSD17B10USP2
SCHEMBL21996592 0.77 HTR6 (0.41) KDM4ELMNAMAPK1HSD17B10HTR6
SCHEMBL27284948 0.77 MAPK1 (0.50) KDM4ELMNAMAPK1HSD17B10USP2
SCHEMBL5845411 0.75 NLRP3 (0.43) CRHR1KDM4ELMNAMAPK1TSHR
SCHEMBL6429167 0.72 MAPK1 (0.47) KDM4ELMNAMAPK1HSD17B10L3MBTL1
SCHEMBL1748473 0.72 MAPK1 (0.46) KDM4ELMNAMAPK1HSD17B10USP2
SCHEMBL27289016 0.71 SMN1; SMN2 (0.46) KDM4ELMNAMAPK1HSD17B10USP2
SCHEMBL1055154 0.70 MAPK1 (0.53) KDM4ELMNAMAPK1HSD17B10TSHR
SCHEMBL4772509 0.70 TSHR (0.40) KDM4EMAPK1HSD17B10USP2TSHR
SCHEMBL7476102 0.69 CRHR1 (0.40) CRHR1KDM4EMAPTALDH1A1MEN1

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
US-6833378-B2 Pyridines, pyrimidines, purinones, pyrrolopyrimidinones and pyrrolopyridinones; useful in the treatment disorders including CNS and stress-related disorders. PFIZER INC 2004-12-21 US disclosed
EP-1263732-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS Pfizer Products Inc. (US) 2002-12-11 EP disclosed
US-20020016328-A1 Corticotropin releasing factor antagonists PFIZER INC. 2002-02-07 US disclosed
WO-2001053263-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2001-07-26 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 (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-20020016328-A1 Corticotropin releasing factor antagonists CRH, CRHR2, CRHR1 CRHR1 3/4885KDM4E 2820/4885LMNA 4189/4885
US-20050032846-A1 Corticotropin releasing factor antagonists CRH, CRHR2, CRHR1 CRHR1 3/4885KDM4E 4501/4885LMNA 4152/4885

“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.