SCHEMBL4833165

SCHEMBL4833165

COc1ccc(C2N=c3occc3=C(N)N2c2ccc(N(C(N)=O)c3ccccc3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ POLB P06746 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ PDE5A O76074 3/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ F2 P00734 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ TRPM8 Q7Z2W7 1/20 0.33
▸ SOAT1 P35610 1/20 0.33
▸ NPBWR1 P48145 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ HSD11B1 P28845 1/20 0.32

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
SCHEMBL4834339 0.92 ALDH1A1 (0.37) ALDH1A1POLB
SCHEMBL4836558 0.85 ALDH1A1 (0.43) ALDH1A1PDE5A
SCHEMBL4833641 0.84 ALDH1A1 (0.49) ALDH1A1L3MBTL1KMT2AKDM4EGAA
SCHEMBL4836547 0.84 ALDH1A1 (0.43) ALDH1A1L3MBTL1HPGDKDM4EHSD17B10
SCHEMBL4826532 0.84 ALDH1A1 (0.43) ALDH1A1L3MBTL1HPGDKDM4EHSD17B10
SCHEMBL4829331 0.84 ALDH1A1 (0.43) ALDH1A1KMT2ASOAT1KDM4EHSD11B1
SCHEMBL4826095 0.83 ALDH1A1 (0.34) ALDH1A1KMT2A
SCHEMBL4833422 0.83 TRPM8 (0.36) ALDH1A1KMT2ATRPM8
SCHEMBL4825771 0.83 ALOX15 (0.39) ALDH1A1L3MBTL1POLBGAA
SCHEMBL4833908 0.81 ALDH1A1 (0.40) ALDH1A1KMT2AHPGDKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF ADAMS JERRY LEROY 2008-11-20 — — US claimed
US-20050004142-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2005-01-06 — — US claimed
EP-1425284-A2 FURO- AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-06-09 — — EP claimed
WO-2003022852-A2 FURO-AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-20 — — WO claimed
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF ADAMS JERRY LEROY 2008-11-20 — — US disclosed
US-7427623-B2 4-Amino-2,3-disubstituted thieno[2,3-d]pyrimidines and pharmacetical compositions thereof SMITHKLINE BEECHAM CORPORATION (US) 2008-09-23 — — US disclosed
US-20050004142-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2005-01-06 — — US disclosed
EP-1425284-A2 FURO- AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-06-09 — — EP disclosed
WO-2003022852-A2 FURO-AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-20 — — 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-20050004142-A1 Chemical compounds TIE1, KDR, TEK ALDH1A1 906/4885L3MBTL1 3368/4885POLB 928/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR ALDH1A1 1144/4885L3MBTL1 3908/4885POLB 1327/4885

“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.

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