SCHEMBL5617809

SCHEMBL5617809

Cc1cc2ccc(OCc3ccc(C(C)C)cc3)cc2oc1=O

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.68
CA12 O43570 1/20 0.68
CA1 P00915 1/20 0.68
CA2 P00918 1/20 0.68
CA4 P22748 1/20 0.68
CA5A P35218 1/20 0.68
CA7 P43166 1/20 0.68
CA5B Q9Y2D0 1/20 0.68
ACHE P22303 4/20 0.64
MAOA P21397 5/20 0.59
AR P10275 1/20 0.56
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
SLC16A3 O15427 2/20 0.51

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
SCHEMBL28440656 0.85 MAOB (0.71) MAOBCA12CA1CA2CA4
SCHEMBL29724495 0.85 MAOB (0.71) MAOBCA12CA1CA2CA4
SCHEMBL28373047 0.84 SLC16A3 (0.75) MAOBCA12CA1CA2CA4
SCHEMBL5617763 0.84 NPC1 (0.74) MAOBCA12CA1CA2CA4
SCHEMBL5618032 0.81 MAOB (0.77) MAOBACHEMAOAAR
SCHEMBL5618481 0.79 MAOB (0.77) MAOBCA12CA1CA2CA4
SCHEMBL7309342 0.79 CA12 (0.52) MAOBCA12CA1CA2CA4
SCHEMBL10140560 0.78 HSD17B3 (0.60) MAOBCA12CA1CA2CA4
SCHEMBL5617810 0.78 NPC1 (0.76) MAOBCA12CA1CA2CA4
SCHEMBL7438868 0.78 TDP1 (0.75) MAOBARRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070078172-A1 MAO-B INHIBITORS USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2007-04-05 US claimed
US-20070078172-A1 MAO-B INHIBITORS USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2007-04-05 US disclosed
WO-2006138475-A2 MAO-B INHIBITORS USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2006-12-28 WO disclosed
EP-0363793-B1 ARYL ALKOXY COUMARINS, PROCESS FOR THEIR PRODUCTION AND THERAPEUTIC AGENTS CONTAINING THEM BASF Aktiengesellschaft (DE) 1993-04-21 EP disclosed
US-5100914-A Monoamine Oxidase Inhibitors, Central Nervous System Disorders BASF AKTIENGESELLSCHAFT (DE) 1992-03-31 US disclosed
EP-0363793-A1 Aryl alkoxy coumarins, process for their production and therapeutic agents containing them BASF Aktiengesellschaft (DE) 1990-04-18 EP 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-20070078172-A1 MAO-B INHIBITORS USEFUL FOR TREATING OBESITY MAOB, MAOA, GPR119 MAOB 1/4885CA12 4798/4885CA1 4665/4885

“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.