SCHEMBL3608649

SCHEMBL3608649

CCOC(=O)c1cc(Cl)c(Br)cc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51
BAZ2B Q9UIF8 1/20 0.48
BAZ2A Q9UIF9 1/20 0.48
MAOB P27338 1/20 0.47
CA1 P00915 5/20 0.47
CA2 P00918 5/20 0.47
CA12 O43570 4/20 0.47
CA9 Q16790 4/20 0.47
TSHR P16473 1/20 0.46
CA7 P43166 3/20 0.42
CA14 Q9ULX7 3/20 0.42
KDM4E B2RXH2 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL4625497 0.90 CYP4F2 (0.54) CYP4F2CYP4A11BAZ2BBAZ2AMAOB
SCHEMBL29923060 0.86 CYP4F2 (0.53) CYP4F2CYP4A11BAZ2BBAZ2ACA1
SCHEMBL6732086 0.86 CYP4F2 (0.53) CYP4F2CYP4A11BAZ2BBAZ2ACA1
SCHEMBL5088670 0.85 CYP4F2 (0.56) CYP4F2CYP4A11BAZ2BBAZ2AMAOB
SCHEMBL8137124 0.84 TSHR (0.50) CYP4F2CYP4A11MAOBCA1CA2
SCHEMBL18703677 0.83 GAA (0.46) CA1CA2CA12CA9CA7
SCHEMBL34463695 0.83 TSHR (0.50) CYP4F2CYP4A11BAZ2BBAZ2AMAOB
SCHEMBL31497641 0.82 CA1 (0.53) CYP4F2CYP4A11BAZ2BBAZ2AMAOB
SCHEMBL8712980 0.82 CA1 (0.53) CYP4F2CYP4A11BAZ2BBAZ2AMAOB
SCHEMBL1560843 0.81 CYP4F2 (0.56) CYP4F2CYP4A11BAZ2BBAZ2AMAOB

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-20100105673-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-04-29 US disclosed
US-20100105673-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-04-29 US disclosed
US-20100105673-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-04-29 US disclosed
EP-2102180-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE Bayer Schering Pharma Aktiengesellschaft (DE) 2009-09-23 EP disclosed
WO-2008071359-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-19 WO disclosed
WO-2008071359-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-19 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 (1 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-20100105673-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE FANCF, TPMT, AAAS CYP4F2 101/4885CYP4A11 1545/4885BAZ2B 1164/4885

“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.