SCHEMBL5024682

SCHEMBL5024682

N#Cc1c(Cl)nc(-c2ccncc2)nc1-c1cccc([N+](=O)[O-])c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.65
MEN1 O00255 2/20 0.65
NPC1 O15118 2/20 0.52
MAPT P10636 2/20 0.52
RAB9A P51151 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
ABCG2 Q9UNQ0 2/20 0.45
POLB P06746 2/20 0.44
ALOX5 P09917 1/20 0.43
MYC P01106 1/20 0.43
WDR5 P61964 1/20 0.43
PDE4D Q08499 3/20 0.42
PDE4B Q07343 2/20 0.42
PDE4A P27815 1/20 0.42
PDE4C Q08493 1/20 0.42

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
SCHEMBL4423874 0.92 KMT2A (0.58) KMT2AMEN1NPC1MAPTRAB9A
SCHEMBL5026966 0.87 NPC1 (0.52) KMT2AMEN1NPC1MAPTRAB9A
SCHEMBL5026076 0.84 MAPT (0.52) KMT2AMEN1NPC1MAPTRAB9A
SCHEMBL5024711 0.82 NPC1 (0.53) KMT2AMEN1NPC1MAPTRAB9A
SCHEMBL4422399 0.79 CYP1A2 (0.56) KMT2AMEN1NPC1MAPTRAB9A
SCHEMBL4421556 0.78 NPC1 (0.49) NPC1MAPTRAB9AALDH1A1ABCG2
SCHEMBL10377354 0.78 NPC1 (0.49) KMT2AMEN1NPC1MAPTRAB9A
SCHEMBL4904156 0.76 PDE4D (0.47) NPC1MAPTRAB9AALDH1A1MYC
SCHEMBL4898316 0.75 CTSL (0.50) ABCG2MYCWDR5PDE4DKDM4E
SCHEMBL19305511 0.72 KMT2A (0.85) KMT2AMEN1RAB9ACYP1A2CYP2C9

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-7375109-B2 Glycine-substituted thieno[2,3-d]pyrimidines with combined LH and FSH agonistic activity N.V. ORGANON (NL) 2008-05-20 US disclosed
EP-1427734-B1 GLYCINE-SUBSTITUTED THIENO[2,3-d]PYRIMIDINES WITH COMBINED LH AND FSH AGONISTIC ACTIVITY AKZO NOBEL NV (NL) 2005-11-09 EP disclosed
US-20040180907-A1 Glycine-substituted thieno{2,3-d}pyrimidines with combined lh and fsh agonistic activity MERCK SHARP & DOHME B.V. (NL) 2004-09-16 US disclosed
EP-1427734-A1 GLYCINE-SUBSTITUTED THIENO 2,3-d]PYRIMIDINES WITH COMBINED LH AND FSH AGONISTIC ACTIVITY Akzo Nobel N.V. (NL) 2004-06-16 EP disclosed
WO-2003020727-A1 GLYCINE-SUBSTITUTED THIENO [2,3-d]PYRIMIDINES WITH COMBINED LH AND FSH AGONISTIC ACTIVITY AKZO NOBEL N.V. (NL) 2003-03-13 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 (1 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-20040180907-A1 Glycine-substituted thieno{2,3-d}pyrimidines with combined lh and fsh agonistic activity FSHR, GNRHR, LHCGR KMT2A 980/4885MEN1 4277/4885NPC1 3425/4885

“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.