SCHEMBL4835262

SCHEMBL4835262

COc1ccc(N2C(N)=c3ccoc3=NC2c2cccc(C(=O)N3CCN(C)CC3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 3/20 0.42
▸ PARP14 Q460N5 1/20 0.41
▸ PARP10 Q53GL7 1/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ PDE2A O00408 1/20 0.40
▸ PDE11A Q9HCR9 1/20 0.40
▸ PDE10A Q9Y233 1/20 0.40
▸ DRD2 P14416 2/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ RAB9A P51151 2/20 0.39
▸ ALDH1A1 P00352 6/20 0.39
▸ TSHR P16473 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ LMNA P02545 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HTR2A P28223 1/20 0.38

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
SCHEMBL4835654 0.87 PARP1 (0.39) PARP14PARP10KMT2ADRD2ALDH1A1
SCHEMBL4833358 0.87 PDE5A (0.38) PDE5AKMT2AMEN1RAB9AALDH1A1
SCHEMBL4836536 0.86 L3MBTL1 (0.39) ALDH1A1TSHRL3MBTL1LMNAMAPT
SCHEMBL4835183 0.82 ALDH1A1 (0.48) PDE5AKMT2AMEN1RAB9AALDH1A1
SCHEMBL4833484 0.82 HSD11B1 (0.43) KMT2AMEN1ALDH1A1MAPTMAPK1
SCHEMBL4825906 0.81 ALDH1A1 (0.39) KMT2AMEN1RAB9AALDH1A1LMNA
SCHEMBL4830808 0.80 KMT2A (0.42) KMT2AMEN1RAB9AALDH1A1LMNA
SCHEMBL4835178 0.79 ACSS2 (0.37) PARP14KMT2AMEN1DRD2RAB9A
SCHEMBL4834312 0.79 FYN (0.41) DRD3ALDH1A1MAPK1HPGD
SCHEMBL4828806 0.79 ALDH1A1 (0.50) KMT2AMEN1RAB9AALDH1A1TSHR

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 5 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 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 PDE5A 2866/4885PARP14 516/4885PARP10 724/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR PDE5A 2228/4885PARP14 559/4885PARP10 871/4885

“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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