SCHEMBL4833372

SCHEMBL4833372

COc1ccc(N2C(c3cccc(C(=O)O)c3)=Nc3occc3C2N)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A1 P68400 2/20 0.41
▸ STIM1 Q13586 3/20 0.41
▸ ORAI1 Q96D31 3/20 0.41
▸ RAB9A P51151 3/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ PTPN11 Q06124 4/20 0.40
▸ PDE5A O76074 3/20 0.39
▸ TP53 P04637 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ MRGPRX4 Q96LA9 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ RPA1 P27694 1/20 0.37
▸ NR4A2 P43354 1/20 0.37
▸ CYP2C9 P11712 1/20 0.36

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
SCHEMBL4835662 0.92 PARP1 (0.40) CSNK2A1RAB9AMEN1KMT2APDE5A
SCHEMBL4836670 0.91 CHRM2 (0.38) RAB9AMEN1KMT2ATP53MRGPRX4
SCHEMBL4833798 0.90 TEK (0.43) CSNK2A1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4836559 0.88 CA1 (0.42) CSNK2A1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4835270 0.86 MEN1 (0.46) RAB9AMEN1KMT2APDE5A
SCHEMBL4830822 0.85 KMT2A (0.43) RAB9AMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4825912 0.85 KMT2A (0.38) RAB9AMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4835205 0.84 ACSS2 (0.43) MEN1KMT2ASMN1; SMN2CYP2C9LMNA
SCHEMBL4833776 0.84 FYN (0.46) MEN1KMT2APKMLMNA
SCHEMBL4834328 0.84 FYN (0.47) CYP2C9

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 CSNK2A1 3893/4885STIM1 2358/4885ORAI1 4778/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR CSNK2A1 3007/4885STIM1 2410/4885ORAI1 4620/4885

“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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