SCHEMBL4129784

SCHEMBL4129784

CCc1ncc(C(=O)OC)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.52
KDM4E B2RXH2 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.43
ATM Q13315 1/20 0.43
TSHR P16473 1/20 0.42
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA12 O43570 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
LOXL2 Q9Y4K0 1/20 0.40
PSMD14 O00487 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 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
SCHEMBL16769968 0.84 MAPK1 (0.52) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL25213656 0.82 MAPK1 (0.50) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL4594866 0.82 MAPK1 (0.50) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL18198247 0.82 CYP2C9 (0.50) MAPK1MAPTALDH1A1ATMTSHR
SCHEMBL27621013 0.82 MAPK1 (0.46) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL19776257 0.81 MAPK1 (0.49) MAPK1KDM4EL3MBTL1MAPTALDH1A1
Hydrochloric Acid SCHEMBL28379955 0.81 LOXL2 (0.50) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL1810517 0.79 MAPK1 (0.47) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL27621012 0.79 MAPK1 (0.47) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL19782994 0.78 MAPK1 (0.50) MAPK1KDM4EL3MBTL1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10556889-B1 Salvinorin derivatives Blue Sky Pharmaceuticals, LLC (US) 2020-02-11 US disclosed
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 (3 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 MAPK1 1369/4885KDM4E 4797/4885L3MBTL1 4677/4885
US-10556889-B1 Salvinorin derivatives OPRD1, OPRK1, OPRL1 MAPK1 653/4885KDM4E 4632/4885L3MBTL1 2538/4885
US-20090181966-A1 PGD2 receptor antagonists for the treatment of inflammatory diseases PTGDR2, LTB4R2, CYSLTR2 MAPK1 1369/4885KDM4E 4797/4885L3MBTL1 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.