SCHEMBL4829045

SCHEMBL4829045

COc1cc(OC)cc(S(=O)(=O)Nc2ccc(N3CN=c4occc4=C3N)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ ALDH1A1 P00352 4/20 0.39
▸ LMNA P02545 3/20 0.39
▸ PKM P14618 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ NPY5R Q15761 4/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ PGR P06401 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HTR6 P50406 1/20 0.38
▸ ATM Q13315 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ ALOX15 P16050 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
SCHEMBL4833991 0.92 ALDH1A1 (0.49) ALDH1A1LMNAPKMSMN1; SMN2GAA
SCHEMBL4831475 0.91 KMT2A (0.52) KMT2AALDH1A1LMNAPKMSMN1; SMN2
SCHEMBL4836848 0.85 ALPL (0.51) KMT2AALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL4834472 0.85 CYP3A4 (0.47) PGRHTR6
SCHEMBL4833946 0.83 KEAP1 (0.46) KMT2AALDH1A1LMNAPKMNPY5R
SCHEMBL4833691 0.82 PSEN1 (0.44) LMNANPY5RMAPTPGR
SCHEMBL4834402 0.82 ALDH1A1 (0.49) KMT2AALDH1A1LMNAPKMSMN1; SMN2
SCHEMBL4829022 0.81 MAPT (0.49) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL4834019 0.81 ALDH1A1 (0.51) KMT2AALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL4833803 0.81 POLB (0.47) KMT2AALDH1A1LMNAPKMSMN1; SMN2

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 claimed
US-20050004142-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2005-01-06 — — US 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

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 KMT2A 324/4885ALDH1A1 906/4885LMNA 4230/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR KMT2A 334/4885ALDH1A1 1144/4885LMNA 4131/4885

“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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