SCHEMBL4516193

SCHEMBL4516193

Cc1cc(OCc2ccccc2)cc(=O)o1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.58
▸ NPC1 O15118 3/20 0.58
▸ MAOA P21397 2/20 0.58
▸ PKM P14618 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ CASP3 P42574 1/20 0.58
▸ SENP8 Q96LD8 1/20 0.58
▸ SENP7 Q9BQF6 1/20 0.58
▸ SENP6 Q9GZR1 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ CA12 O43570 1/20 0.52
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ CA3 P07451 1/20 0.52
▸ CA4 P22748 1/20 0.52
▸ CA6 P23280 1/20 0.52
▸ CA7 P43166 1/20 0.52

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
Valine SCHEMBL8679327 0.85 IDH1 (0.47) MAOBNPC1MAOAPKMRAB9A
SCHEMBL10659949 0.81 MAOB (0.52) MAOBNPC1MAOAPKMRAB9A
SCHEMBL10657318 0.81 MAOB (0.52) MAOBNPC1MAOAPKMRAB9A
SCHEMBL10661111 0.79 ABCB1 (0.61) MAOBNPC1MAOAPKMRAB9A
SCHEMBL10660651 0.79 MAOB (0.50) MAOBNPC1MAOAPKMRAB9A
SCHEMBL10659155 0.78 MAOB (0.49) MAOBNPC1MAOAPKMRAB9A
SCHEMBL7964491 0.77 KDM4E (0.60) NPC1PKMRAB9AMEN1KMT2A
SCHEMBL10659602 0.77 MAOB (0.48) MAOBNPC1MAOAPKMRAB9A
SCHEMBL25173859 0.76 ACHE (0.54) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL6173807 0.75 MAOA (0.50) MAOBNPC1MAOARAB9AMEN1

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-5731344-A DIABETES, ATHEROSCLEROSIS, ARTERIOSCLEROSIS; INHIBITORS OF ADVANCED GLYCOSYLATION ENDPRODUCTS BOEHRINGER MANNHEIM GMBH (DE) 1998-03-24 — — US claimed
US-20090298894-A1 AMINO ACID COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2009-12-03 — — US disclosed
US-6288109-B1 Pyranones, method for the production and use thereof DR. WILLMAR SCHWABE GMBH & CO. (DE) 2001-09-11 — — US disclosed
EP-1032572-A2 PYRANONES, METHOD FOR THE PRODUCTION AND USE THEREOF Dr. Willmar Schwabe GmbH & Co. (DE) 2000-09-06 — — EP disclosed
WO-1999025716-A9 PYRANONES, METHOD FOR THE PRODUCTION AND USE THEREOF SCHWABE WILLMAR GMBH & CO (DE) 1999-09-02 — — WO disclosed
WO-1999025716-A2 PYRANONES, METHOD FOR THE PRODUCTION AND USE THEREOF DR. WILLMAR SCHWABE GMBH & CO. (DE) 1999-05-27 — — WO disclosed
US-4745116-A INHIBITORS OF SERINE PROTEASE SYNTEX (U.S.A.) INC. (US) 1988-05-17 — — 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 (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-20090298894-A1 AMINO ACID COMPOUNDS S1PR1, S1PR2, S1PR5 MAOB 4469/4885NPC1 691/4885MAOA 4558/4885

“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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