SCHEMBL4863284

SCHEMBL4863284

Cc1cccc(-c2c(-c3ccc4c(c3)OCO4)nc3ncccn23)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.64
RAB9A P51151 2/20 0.64
ALDH1A1 P00352 4/20 0.51
NPC1 O15118 1/20 0.51
TGFBR1 P36897 9/20 0.50
TDP1 Q9NUW8 3/20 0.50
MAPK14 Q16539 2/20 0.50
RIPK2 O43353 1/20 0.50
ACVR1B P36896 1/20 0.50
GAA P10253 8/20 0.49
MAPT P10636 7/20 0.49
MAPK1 P28482 4/20 0.49
POLB P06746 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALOX15 P16050 2/20 0.49
HSD17B10 Q99714 1/20 0.49
TSHR P16473 2/20 0.48
TP53 P04637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL23407673 0.84 KDM4E (0.65) KDM4ERAB9AALDH1A1NPC1TGFBR1
SCHEMBL4864372 0.83 GAA (0.53) KDM4ERAB9AALDH1A1NPC1TGFBR1
SCHEMBL4866889 0.80 TGFBR1 (0.53) RAB9ANPC1TGFBR1MAPK14POLB
SCHEMBL5265691 0.78 GAA (0.62) KDM4ERAB9AALDH1A1NPC1TDP1
SCHEMBL29620822 0.78 RAB9A (0.56) KDM4ERAB9AALDH1A1NPC1TDP1
SCHEMBL23407593 0.78 RAB9A (0.56) KDM4ERAB9AALDH1A1NPC1TDP1
SCHEMBL15640139 0.77 TGFBR1 (0.56) KDM4ERAB9AALDH1A1NPC1TGFBR1
SCHEMBL23407705 0.76 RAB9A (0.54) KDM4ERAB9AALDH1A1NPC1TDP1
SCHEMBL29620824 0.76 RAB9A (0.54) KDM4ERAB9AALDH1A1NPC1TDP1
SCHEMBL22394795 0.76 KDM4E (0.56) KDM4ERAB9AALDH1A1NPC1TDP1

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-7417041-B2 Imidazopyrimidines as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2008-08-26 US claimed
US-20040176390-A1 Novel fused heteroaromatic compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-09-09 US claimed
US-20080275235-A1 NOVEL FUSED HETEROAROMATIC COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER INC. (US) 2008-11-06 US disclosed
US-7417041-B2 Imidazopyrimidines as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2008-08-26 US disclosed
EP-1601676-A2 FUSED IMIDAZOLES AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS Pfizer Products Inc. (US) 2005-12-07 EP disclosed
WO-2004078110-A2 FUSED IMIZADOLES AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PRODUCTS INC. (US) 2004-09-16 WO disclosed
US-20040176390-A1 Novel fused heteroaromatic compounds as transforming growth factor (TGF) inhibitors PFIZER INC 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-20080275235-A1 NOVEL FUSED HETEROAROMATIC COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS TGFBR1, SMAD3, SMAD2 KDM4E 1485/4885RAB9A 2755/4885ALDH1A1 1680/4885
US-20040176390-A1 Novel fused heteroaromatic compounds as transforming growth factor (TGF) inhibitors SMAD3, TGFBR1, SMAD2 KDM4E 1697/4885RAB9A 2931/4885ALDH1A1 1547/4885

“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.