SCHEMBL4826222

SCHEMBL4826222

Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(N2CN=c3occc3=C2N)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.46
▸ KDM4E B2RXH2 4/20 0.44
▸ TP53 P04637 1/20 0.40
▸ GAA P10253 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ MAPT P10636 4/20 0.38
▸ PPARG P37231 3/20 0.37
▸ PPARA Q07869 3/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HSD17B10 Q99714 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
SCHEMBL4828947 0.76 POLB (0.53) KDM4EGAALMNANPC1RAB9A
SCHEMBL4828919 0.73 POLB (0.46) KDM4EGAALMNARAB9AMAPT
SCHEMBL4826236 0.73 KDM4E (0.44) MCHR1KDM4ETP53GAALMNA
SCHEMBL4833594 0.72 PSEN1 (0.46) LMNAMAPTCSF1R
SCHEMBL12530739 0.72 MCHR1 (0.67) MCHR1KDM4ELMNANPC1RAB9A
SCHEMBL4836565 0.70 RAB9A (0.41) KDM4ETP53GAALMNANPC1
SCHEMBL4833622 0.69 RAB9A (0.47) GAANPC1RAB9AMAPT
SCHEMBL4832987 0.69 NPC1 (0.47) KDM4ETP53GAALMNANPC1
SCHEMBL4831180 0.69 CNR1 (0.39) TP53LMNANPC1RAB9AMAPT
SCHEMBL4836200 0.69 CA12 (0.48) NPC1RAB9AMAPTCSF1R

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 7 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
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 MCHR1 3884/4885KDM4E 580/4885TP53 54/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR MCHR1 4145/4885KDM4E 202/4885TP53 144/4885

“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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