SCHEMBL2763233

SCHEMBL2763233

CN(C)C(=O)CCC/C=C/c1cccc(C(=O)NCCF)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SIGMAR1 Q99720 4/20 0.38
TMEM97 Q5BJF2 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
NAMPT P43490 1/20 0.36
POLB P06746 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SREBF2 Q12772 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
TP53BP1 Q12888 2/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL2763234 1.00 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL2623654 1.00 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL16799707 0.89 LMNA (0.42) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL16799709 0.89 LMNA (0.42) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL20810547 0.88 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL16800065 0.87 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL16800066 0.87 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL16800064 0.87 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL20810390 0.86 SMN1; SMN2 (0.38) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97
SCHEMBL16799902 0.86 SMN1; SMN2 (0.41) SMN1; SMN2KMT2AMEN1SIGMAR1TMEM97

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 10 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-9120723-B2 Modulator CANBEX THERAPEUTICS LIMITED (GB) 2015-09-01 US disclosed
US-20130123356-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2013-05-16 US disclosed
EP-2177503-B1 MODULATORS OF CANNABINOID RECEPTORS UCL BUSINESS PLC (GB) 2013-04-10 EP disclosed
US-8293796-B2 Modulator UNIVERSITY COLLEGE LONDON (GB) 2012-10-23 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
EP-1745011-B1 MODULATORS OF CANNABINOID RECEPTORS UCL BUSINESS PLC (GB) 2009-09-30 EP 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 SMN1; SMN2 261/4885KMT2A 2468/4885MEN1 3055/4885
US-20160107984-A1 MODULATOR CHRNA3, CHRNB3, CHRM3 SMN1; SMN2 106/4885KMT2A 2594/4885MEN1 2544/4885
US-20130123356-A1 MODULATOR MRGPRX2, NR3C2, MC2R SMN1; SMN2 3589/4885KMT2A 3127/4885MEN1 1627/4885
US-20100144876-A1 MODULATOR CHRNA3, CHRM3, NR3C2 SMN1; SMN2 261/4885KMT2A 2468/4885MEN1 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.