SCHEMBL2632341

SCHEMBL2632341

CC(CO)NC(=O)c1cccc(CCCC(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.47
MEN1 O00255 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
HDAC3 O15379 1/20 0.46
MAPK1 P28482 1/20 0.46
ADRA1A P35348 1/20 0.46
HDAC4 P56524 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
CYP4F2 P78329 1/20 0.45

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
SCHEMBL13323630 0.96 HPGD (0.49) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL13323523 0.92 HPGD (0.52) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL13324059 0.88 CYP4F2 (0.55) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL13324060 0.88 CYP4F2 (0.49) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL13323521 0.88 SMN1; SMN2 (0.46) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL2632342 0.86 HPGD (0.44) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL13323770 0.86 SPHK2 (0.52) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL2763884 0.85 SPHK2 (0.54) HPGDSMN1; SMN2CYP4F2CYP4A11PPARG
SCHEMBL13323833 0.84 HPGD (0.46) HPGDSMN1; SMN2MEN1HTTKMT2A
SCHEMBL13323527 0.83 CYP4F2 (0.44) HPGDSMN1; SMN2MEN1HTTKMT2A

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-20160107984-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2016-04-21 US disclosed
US-8293796-B2 Modulator UNIVERSITY COLLEGE LONDON (GB) 2012-10-23 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-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-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 (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-20080114062-A1 Modulator CHRNA3, CHRM3, NR3C2 HPGD 2698/4885SMN1; SMN2 261/4885MEN1 3055/4885
US-20160107984-A1 MODULATOR CHRNA3, CHRNB3, CHRM3 HPGD 1896/4885SMN1; SMN2 106/4885MEN1 2544/4885
US-20120101301-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS CPT1B, MUSK, C1R HPGD 2246/4885SMN1; SMN2 70/4885MEN1 2830/4885
US-20100144876-A1 MODULATOR CHRNA3, CHRM3, NR3C2 HPGD 2698/4885SMN1; SMN2 261/4885MEN1 3055/4885

“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.