SCHEMBL4834636

SCHEMBL4834636

COc1ccc(N2C(N)=c3ccoc3=NC2c2ccc(CCC(=O)O)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.39
▸ PLA2G4A P47712 4/20 0.38
▸ MAPT P10636 3/20 0.37
▸ POLB P06746 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.36
▸ F2RL1 P55085 1/20 0.36
▸ SOAT1 P35610 1/20 0.35
▸ FKBP1A P62942 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ TLR7 Q9NYK1 1/20 0.35
▸ GAA P10253 1/20 0.34

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
SCHEMBL4825681 0.86 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1SMN1; SMN2HPGD
SCHEMBL4836558 0.86 ALDH1A1 (0.43) ALDH1A1
SCHEMBL4833641 0.86 ALDH1A1 (0.49) ALDH1A1MAPTL3MBTL1SMN1; SMN2KDM4E
SCHEMBL4833955 0.86 ALDH1A1 (0.41) ALDH1A1MAPTL3MBTL1SMN1; SMN2HPGD
SCHEMBL4835851 0.85 ALDH1A1 (0.43) ALDH1A1POLBSMN1; SMN2SOAT1TP53
SCHEMBL4833680 0.83 ALDH1A1 (0.46) ALDH1A1MAPTSMN1; SMN2HPGDKDM4E
SCHEMBL4829331 0.81 ALDH1A1 (0.43) ALDH1A1MAPTKDM4EKMT2ASOAT1
SCHEMBL4836450 0.81 ALDH1A1 (0.40) ALDH1A1MAPTSMN1; SMN2HPGDKDM4E
SCHEMBL4833908 0.81 ALDH1A1 (0.40) ALDH1A1MAPTSMN1; SMN2HPGDKDM4E
SCHEMBL4836404 0.81 PLK1 (0.44) ALDH1A1MAPTSMN1; SMN2HPGDKDM4E

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 FFAR1 3373/4885ALDH1A1 906/4885PLA2G4A 3841/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR FFAR1 2495/4885ALDH1A1 1144/4885PLA2G4A 3594/4885

“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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