SCHEMBL910695

SCHEMBL910695

CCOc1ccccc1C[C]=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.59
MAPT P10636 3/20 0.59
NPSR1 Q6W5P4 1/20 0.59
ALDH1A1 P00352 5/20 0.47
GLA P06280 1/20 0.46
ATM Q13315 2/20 0.45
POLB P06746 2/20 0.45
GAA P10253 2/20 0.45
MEN1 O00255 1/20 0.45
THRB P10828 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
KMT2A Q03164 1/20 0.45
PLEC Q15149 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 2/20 0.42
HTR7 P34969 1/20 0.42
TP53 P04637 2/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL910377 0.85 L3MBTL1 (0.51) L3MBTL1MAPTNPSR1ALDH1A1ATM
SCHEMBL3202776 0.84 CYP1A2 (0.51) L3MBTL1MAPTNPSR1ALDH1A1ATM
SCHEMBL910555 0.81 L3MBTL1 (0.56) L3MBTL1MAPTNPSR1ALDH1A1GLA
SCHEMBL31054 0.81 L3MBTL1 (0.84) L3MBTL1MAPTNPSR1ALDH1A1GLA
SCHEMBL9260429 0.81 MAPT (0.51) L3MBTL1MAPTNPSR1ATMMEN1
SCHEMBL4090252 0.81 L3MBTL1 (0.38) L3MBTL1MAPTNPSR1ALDH1A1ATM
SCHEMBL4090053 0.81 MAPT (0.38) L3MBTL1MAPTNPSR1ALDH1A1ATM
SCHEMBL4090048 0.81 L3MBTL1 (0.42) L3MBTL1MAPTNPSR1TDP1KDM4E
SCHEMBL7197450 0.81 L3MBTL1 (0.55) L3MBTL1MAPTNPSR1ALDH1A1GLA
SCHEMBL188509 0.80 TAAR1 (0.57) L3MBTL1MAPTALDH1A1POLBGAA

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170131-A1 Agents for Imaging Apoptosis BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2009-07-02 US claimed
WO-2007134127-A2 AGENTS FOR IMAGING APOPTOSIS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-11-22 WO claimed
CN-102319184-B Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO CO LTD 2015-03-25 CN disclosed
US-8937090-B2 Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO COMPANY, LTD. (JP) 2015-01-20 US disclosed
US-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin SHISEIDO COMPANY, LTD. (JP) 2012-09-13 US disclosed
US-20120165409-A1 WRINKLE-IMPROVING AGENT SHISEIDO COMPANY, LTD. (JP) 2012-06-28 US disclosed
CN-101267803-B Wrinkle-improving agent SHISEIDO CO LTD 2011-06-08 CN disclosed
US-20110004019-A1 Parakeratosis Inhibitor, Pore-Shrinking Agent, Or Rough Skin Inhibiting/Ameliorating Agent, And External Composition For Skin Containing The Same SHISEIDO COMPANY LTD. (JP) 2011-01-06 US disclosed
EP-2255780-A1 PARAKERATOSIS INHIBITOR, PORE SHRINKING AGENT OR AGENT FOR PREVENTING OR IMPROVING ROUGH SKIN, AND COMPOSITION FOR EXTERNAL USE ON THE SKIN CONTAINING THE SAME Shiseido Company, Ltd. (JP) 2010-12-01 EP disclosed
US-20100035881-A1 WRINKLE-IMPROVING AGENT SHISEIDO COMPANY, LTD. (JP) 2010-02-11 US disclosed
US-20090170131-A1 Agents for Imaging Apoptosis BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2009-07-02 US disclosed
US-4394313-A Symmetrical azetidinone aldehyde disulfides and process ELI LILLY AND COMPANY (US) 1983-07-19 US disclosed
US-4361515-A Antihyperlipemic dihydro-ML-236B derivatives, their preparation and use SANKYO COMPANY, LIMITED (JP) 1982-11-30 US disclosed
US-4336191-A Penicillin conversion by halogen electrophiles and anti-bacterials derived thereby ELI LILLY AND COMPANY (US) 1982-06-22 US disclosed
US-4335240-A Process for cyclization ELI LILLY AND COMPANY (US) 1982-06-15 US disclosed
US-4320055-A Process for penicillin epimerization ELI LILLY AND COMPANY (US) 1982-03-16 US disclosed
US-4302391-A Unsymmetrical azetidinone aldehyde disulfides and process ELI LILLY AND COMPANY (US) 1981-11-24 US disclosed
EP-0037729-A2 Process for penicillin epimerization ELI LILLY AND COMPANY (US) 1981-10-14 EP disclosed
US-4293495-A Symmetrical azetidinone aldehyde disulfides and process ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed
US-4293493-A Azetidinone alcohol disulfides and process for cyclization ELI LILLY AND COMPANY (US) 1981-10-06 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 (4 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-20100035881-A1 WRINKLE-IMPROVING AGENT AAAS, GLA, COL14A1 L3MBTL1 874/4885MAPT 2499/4885NPSR1 2216/4885
US-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin CUTA, AAAS, NUP160 L3MBTL1 1100/4885MAPT 2324/4885NPSR1 4560/4885
US-20110004019-A1 Parakeratosis Inhibitor, Pore-Shrinking Agent, Or Rough Skin Inhibiting/Ameliorating Agent, And External Composition For Skin Containing The Same CUTA, GLRA3, ARGLU1 L3MBTL1 3695/4885MAPT 3999/4885NPSR1 2497/4885
US-20120165409-A1 WRINKLE-IMPROVING AGENT AAAS, GLA, COL14A1 L3MBTL1 999/4885MAPT 2212/4885NPSR1 2485/4885

“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.