SCHEMBL40201

SCHEMBL40201

CNc1cccnc1NC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RRM2 P31350 1/20 0.40
NCOA1 Q15788 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
KDM4E B2RXH2 4/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
POLB P06746 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
USP2 O75604 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
GFER P55789 2/20 0.37
MAPK10 P53779 1/20 0.37

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
SCHEMBL29828009 1.00 RRM2 (0.40) RRM2NCOA1NCOA3KDM4ENPC1
Hydrochloric Acid SCHEMBL29508626 0.98 RRM2 (0.39) RRM2NCOA1NCOA3KDM4ENPC1
SCHEMBL24029047 0.81 GRM5 (0.56) KDM4ENPC1RAB9APOLBL3MBTL1
SCHEMBL1746368 0.81 GRM5 (0.49) RRM2NCOA1NCOA3KDM4ENPC1
SCHEMBL12172562 0.80 DHODH (0.49) KDM4ENPC1RAB9AMAPTTDP1
SCHEMBL22000709 0.80 RRM2 (0.38) RRM2NCOA1NCOA3KDM4ENPC1
SCHEMBL22300096 0.80 TSHR (0.36) RRM2NCOA1NCOA3KDM4ENPC1
SCHEMBL22600380 0.80 GRM5 (0.41) RRM2NCOA1NCOA3KDM4ENPC1
SCHEMBL12172496 0.80 DHODH (0.53) NPC1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL23747187 0.80 GRM5 (0.38) RRM2NCOA1NCOA3KDM4ENPC1

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 320 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8211859-B2 α-galactoceramide analogs, their methods of manufacture, intermediate compounds useful in these methods, and pharmaceutical compositions containing them CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-07-03 US claimed
US-20110028411-A1 ALPHA-GALACTOCERAMIDE ANALOGS, THEIR METHODS OF MANUFACTURE, INTERMEDIATE COMPOUNDS USEFUL IN THESE METHODS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFQUE (FR) 2011-02-03 US claimed
WO-2008047249-A9 ALPHA-GALACTOCERAMIDE ANALOGS, THEIR METHODS OF MANUFACTURE, INTERMEDIATE COMPOUNDS USEFUL IN THESE METHODS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2009-12-23 WO claimed
EP-2099813-A2 ALPHA-GALACTOCERAMIDE ANALOGS, THEIR METHODS OF MANUFACTURE, INTERMEDIATE COMPOUNDS USEFUL IN THESE METHODS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Centre National de la Recherche Scientifique (FR) 2009-09-16 EP claimed
US-7511135-B2 Method for manufacture of ceftiofur LUPIN LIMITED (IN) 2009-03-31 US claimed
WO-2008047249-A2 ALPHA-GALACTOCERAMIDE ANALOGS, THEIR METHODS OF MANUFACTURE, INTERMEDIATE COMPOUNDS USEFUL IN THESE METHODS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2008-04-24 WO claimed
EP-1556388-B1 A METHOD FOR MANUFACTURE OF CEFTIOFUR LUPIN LTD (IN) 2007-09-19 EP claimed
US-20060149054-A1 Method for manufacture of ceftiofur LUPIN LIMITED (IN) 2006-07-06 US claimed
EP-1556388-A2 A METHOD FOR MANUFACTURE OF CEFTIOFUR Lupin Limited (IN) 2005-07-27 EP claimed
WO-2004039811-A2 A METHOD FOR MANUFACTURE OF CEFTIOFUR LUPIN LIMITED (IN) 2004-05-13 WO claimed
EP-0068804-B1 PROCESS FOR PRODUCING SUBSTANTIALLY LINEAR CARBONATE POLYMER PPG INDUSTRIES, INC. (US) 1986-04-30 EP claimed
EP-0068804-A1 Process for producing substantially linear carbonate polymer PPG INDUSTRIES, INC. (US) 1983-01-05 EP claimed
US-4365055-A Process for producing substantially linear carbonate polymer PPG INDUSTRIES, INC. (US) 1982-12-21 US claimed
EP-3383386-B1 MODULATORS OF CHEMOKINE RECEPTORS CHEMOCENTRYX INC (US) 2024-02-14 EP disclosed
US-11820759-B2 Modulators of chemokine receptors CHEMOCENTRYX, INC. (US) 2023-11-21 US disclosed
WO-2023116877-A1 HETEROCYCLIC COMPOUND AS TEAD INHIBITOR 武汉人福创新药物研发中心有限公司 2023-06-29 WO disclosed
US-4489189-A FROM TETRABROMOBISPHENOL A AND ETHYLENE GLYCOL PPG INDUSTRIES, INC. (US) 1984-12-18 US disclosed
US-4414396-A FIREPROOFING PPG INDUSTRIES, INC. (US) 1983-11-08 US disclosed
EP-0068804-A1 Process for producing substantially linear carbonate polymer PPG INDUSTRIES, INC. (US) 1983-01-05 EP disclosed
US-4365055-A Process for producing substantially linear carbonate polymer PPG INDUSTRIES, INC. (US) 1982-12-21 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 (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-20060149054-A1 Method for manufacture of ceftiofur APEH, COASY, PCMT1 RRM2 4109/4885NCOA1 4775/4885NCOA3 4794/4885
US-11820759-B2 Modulators of chemokine receptors CCR5, CXCR3, CCR2 RRM2 1788/4885NCOA1 504/4885NCOA3 432/4885
US-20110028411-A1 ALPHA-GALACTOCERAMIDE ANALOGS, THEIR METHODS OF MANUFACTURE, INTERMEDIATE COMPOUNDS USEFUL IN THESE METHODS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GALE, GALNT14, GALC RRM2 1664/4885NCOA1 4705/4885NCOA3 4464/4885

“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.