SCHEMBL4132044

SCHEMBL4132044

CCc1ncc(C(=O)Cl)cn1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
RAB9A P51151 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NAPRT Q6XQN6 1/20 0.36
PKM P14618 1/20 0.36
HCAR3 P49019 6/20 0.35
HCAR2 Q8TDS4 1/20 0.35
DGAT1 O75907 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 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
SCHEMBL186656 0.80 ALDH1A1 (0.52) MAPTRAB9ANAPRTHCAR3HCAR2
SCHEMBL14095724 0.80 KMT2A (0.37) MAPTL3MBTL1HCAR3KMT2A
SCHEMBL17101820 0.78 NNMT (0.45) L3MBTL1LMNA
SCHEMBL4129784 0.75 MAPK1 (0.52) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL4123825 0.75 NAPRT (0.40) RAB9ANAPRTHCAR3DGAT1MEN1
SCHEMBL4121736 0.74 NAPRT (0.41) MAPTRAB9AL3MBTL1NAPRTPKM
SCHEMBL18198247 0.74 CYP2C9 (0.50) MAPTRAB9AMEN1ALDH1A1LMNA
SCHEMBL14782157 0.72 NAPRT (0.41) RAB9AL3MBTL1NAPRTDGAT1ALDH1A1
SCHEMBL6987829 0.72 NAPRT (0.46) RAB9AL3MBTL1NAPRTDGAT1
SCHEMBL20396058 0.70 NAPRT (0.40) L3MBTL1NAPRTHCAR2DGAT1ALDH1A1

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
US-20090181966-A1 PGD2 receptor antagonists for the treatment of inflammatory diseases MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-07-16 US disclosed
US-7504508-B2 PGD2 receptor antagonists for the treatment of inflammatory diseases MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-03-17 US disclosed
CN-101018770-A PGD2 receptor antagonists for the treatment of inflammatory diseases MILLENNIUM PHARM INC (US) 2007-08-15 CN disclosed
EP-1740547-A1 PGD2 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-01-10 EP disclosed
US-20050256158-A1 PGD2 receptor antagonists for the treatment of inflammatory diseases MILLENNIUM PHARMACEUTICALS, INC. 2005-11-17 US disclosed
WO-2005100321-A1 PGD2 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-10-27 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-20050256158-A1 PGD2 receptor antagonists for the treatment of inflammatory diseases PTGDR2, LTB4R2, CYSLTR2 MAPT 4208/4885RAB9A 2883/4885L3MBTL1 4677/4885
US-20090181966-A1 PGD2 receptor antagonists for the treatment of inflammatory diseases PTGDR2, LTB4R2, CYSLTR2 MAPT 4208/4885RAB9A 2883/4885L3MBTL1 4677/4885

“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.