SCHEMBL4067652

SCHEMBL4067652

O=C1OC(c2ccccc2)Cc2ccncc21

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
MAOB P27338 9/20 0.46
CYP19A1 P11511 4/20 0.46
AR P10275 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ADORA3 P0DMS8 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 2/20 0.46
MAOA P21397 2/20 0.40
PSMB5 P28074 1/20 0.40
HTT P42858 1/20 0.40
LDHA P00338 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6254274 0.80 LMNA (0.64) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL29448273 0.80 LMNA (0.64) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL28969537 0.73 MAOB (0.61) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL28969522 0.73 ALDH1A1 (0.55) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL15256129 0.73 ALDH1A1 (0.55) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL28969527 0.73 ALDH1A1 (0.55) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL28969521 0.72 LMNA (0.55) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL28967891 0.72 ALDH1A1 (0.61) ALDH1A1MAOBCYP19A1ARKDM4E
SCHEMBL4071971 0.72 PKN1 (0.54) ALDH1A1MAOBCYP19A1KDM4EHSD17B10
SCHEMBL4467998 0.71 ALDH1A1 (0.46) ALDH1A1MAOBCYP19A1ARKDM4E

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7601736-B2 Such as 3,4-dihydro-pyrano[3,4-c]pyridine-1-on; cytokine suppressive antiinflammatory drugs; analgesics SK CHEMICALS CO., LTD. (KR) 2009-10-13 US claimed
WO-2008123756-A1 A PHARMACEUTICAL COMPOSITIONS CONTAINING LACTON TYPE PYRIDINE DERIVATIVES AS AN EFFECTIVE INGREDIENT FOR THE PREVENTION AND TREATMENT OF ISCHEMIA SK CHEMICALS CO., LTD. (KR) 2008-10-16 WO claimed
US-20070254909-A1 Novel Pyridine Derivatives, a Process for Their Preparation and a Pharmaceutical Composition Containing the Same SK CHEMICALS CO., LTD. (KR) 2007-11-01 US claimed
US-7601736-B2 Such as 3,4-dihydro-pyrano[3,4-c]pyridine-1-on; cytokine suppressive antiinflammatory drugs; analgesics SK CHEMICALS CO., LTD. (KR) 2009-10-13 US disclosed
EP-1706412-A4 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK CHEMICALS CO LTD (KR) 2009-03-18 EP disclosed
US-20070254909-A1 Novel Pyridine Derivatives, a Process for Their Preparation and a Pharmaceutical Composition Containing the Same SK CHEMICALS CO., LTD. (KR) 2007-11-01 US disclosed
EP-1706412-A1 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK Chemicals, Co., Ltd. (KR) 2006-10-04 EP disclosed
WO-2005063768-A1 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK CHEMICALS, CO., LTD. (KR) 2005-07-14 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-20070254909-A1 Novel Pyridine Derivatives, a Process for Their Preparation and a Pharmaceutical Composition Containing the Same IL5, IL1B, P2RY4 ALDH1A1 1008/4885MAOB 760/4885CYP19A1 2060/4885

“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.