SCHEMBL2623655

SCHEMBL2623655

CC(CO)NC(=O)c1cccc(/C=C\CCCCC(=O)N(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.37
KCNK3 O14649 1/20 0.37
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
CNR2 P34972 1/20 0.37
BLM P54132 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAP4K4 O95819 1/20 0.37
HDAC1 Q13547 1/20 0.36

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
SCHEMBL2764772 1.00 ATM (0.37) ATMKCNK3ALDH1A1THRBCNR2
SCHEMBL2764775 1.00 ATM (0.37) ATMKCNK3ALDH1A1THRBCNR2
Vsn-16R SCHEMBL17049466 0.97 ATM (0.38) ATMKCNK3ALDH1A1THRBCNR2
Vsn-16R SCHEMBL2135092 0.97 ATM (0.38) ATMKCNK3ALDH1A1THRBCNR2
Vsn-16R SCHEMBL15896536 0.97 ATM (0.38) ATMKCNK3ALDH1A1THRBCNR2
Vsn-16R SCHEMBL2623648 0.97 ATM (0.38) ATMKCNK3ALDH1A1THRBCNR2
Vsn-16R SCHEMBL1725527 0.97 ATM (0.38) ATMKCNK3ALDH1A1THRBCNR2
Vsn-16R SCHEMBL2763494 0.97 ATM (0.38) ATMKCNK3ALDH1A1THRBCNR2
Vsn-16R SCHEMBL1725526 0.97 ATM (0.38) ATMKCNK3ALDH1A1THRBCNR2
SCHEMBL2765429 0.93 ATM (0.39) ATMALDH1A1MAP4K4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180116983-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION CANBEX THERAPEUTICS LIMITED (GB) 2018-05-03 US disclosed
US-20180116983-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION CANBEX THERAPEUTICS LIMITED (GB) 2018-05-03 US disclosed
WO-2016128771-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION CANBEX THERAPEUTICS LIMITED (GB) 2016-08-18 WO disclosed
US-20160107984-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2016-04-21 US disclosed
US-20160107984-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2016-04-21 US disclosed
US-9120723-B2 Modulator CANBEX THERAPEUTICS LIMITED (GB) 2015-09-01 US disclosed
US-9120723-B2 Modulator CANBEX THERAPEUTICS LIMITED (GB) 2015-09-01 US disclosed
US-9024067-B2 Process for preparing carboxylic acid amides useful in the treatment of muscular disorders CANBEX THERAPEUTICS LIMITED (GB) 2015-05-05 US disclosed
US-9024067-B2 Process for preparing carboxylic acid amides useful in the treatment of muscular disorders CANBEX THERAPEUTICS LIMITED (GB) 2015-05-05 US disclosed
US-20130123356-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2013-05-16 US disclosed
US-20120101301-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS UCL BUSINESS PLC (GB) 2012-04-26 US disclosed
US-20120101301-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS UCL BUSINESS PLC (GB) 2012-04-26 US disclosed
WO-2010116116-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS UCL BUSINESS PLC (GB) 2010-10-14 WO disclosed
US-20100144876-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2010-06-10 US disclosed
US-20100144876-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2010-06-10 US disclosed
EP-2177503-A1 MODULATORS OF CANNABINOID RECEPTORS UCL Business PLC (GB) 2010-04-21 EP disclosed
US-7696382-B2 Modulator UNIVERSITY COLLEGE LONDON (GB) 2010-04-13 US disclosed
US-7696382-B2 Modulator UNIVERSITY COLLEGE LONDON (GB) 2010-04-13 US disclosed
US-20080114062-A1 Modulator UNIVERSITY COLLEGE LONDON WOLFSON INSTITUTE FOR BIOMEDICAL RESEARCH (GB) 2008-05-15 US disclosed
US-20080114062-A1 Modulator UNIVERSITY COLLEGE LONDON WOLFSON INSTITUTE FOR BIOMEDICAL RESEARCH (GB) 2008-05-15 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 (6 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-20080114062-A1 Modulator CHRNA3, CHRM3, NR3C2 ATM 4322/4885KCNK3 720/4885ALDH1A1 3425/4885
US-20160107984-A1 MODULATOR CHRNA3, CHRNB3, CHRM3 ATM 4443/4885KCNK3 510/4885ALDH1A1 4349/4885
US-20130123356-A1 MODULATOR MRGPRX2, NR3C2, MC2R ATM 4751/4885KCNK3 1574/4885ALDH1A1 1637/4885
US-20120101301-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS CPT1B, MUSK, C1R ATM 3139/4885KCNK3 1308/4885ALDH1A1 1230/4885
US-20100144876-A1 MODULATOR CHRNA3, CHRM3, NR3C2 ATM 4322/4885KCNK3 720/4885ALDH1A1 3425/4885
US-20180116983-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION HCN4, KCNJ4, KCNQ4 ATM 3547/4885KCNK3 40/4885ALDH1A1 3891/4885

“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.