SCHEMBL3147016

SCHEMBL3147016

[CH2]CC(=O)Nc1ccc(CNCc2ccc(OC)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.57
LMNA P02545 2/20 0.57
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
SAE1 Q9UBE0 1/20 0.55
UBA2 Q9UBT2 1/20 0.55
ALDH1A1 P00352 4/20 0.55
RAB9A P51151 3/20 0.55
MAPT P10636 2/20 0.55
KLK7 P49862 1/20 0.55
HTT P42858 1/20 0.54
HIF1A Q16665 1/20 0.53
NPC1 O15118 2/20 0.52
HPGD P15428 1/20 0.52
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL482453 0.89 L3MBTL1 (0.69) SMN1; SMN2LMNAMEN1KMT2AL3MBTL1
SCHEMBL3147011 0.79 MEN1 (0.57) SMN1; SMN2LMNAMEN1KMT2ASAE1
SCHEMBL30034264 0.78 SMN1; SMN2 (0.88) SMN1; SMN2LMNAMEN1KMT2AL3MBTL1
SCHEMBL9313874 0.77 L3MBTL1 (0.76) SMN1; SMN2LMNAMEN1KMT2AL3MBTL1
SCHEMBL121529 0.77 CHRM2 (0.70) SMN1; SMN2ALDH1A1HTTKDM4EPOLB
SCHEMBL17916794 0.75 SMN1; SMN2 (0.88) SMN1; SMN2MEN1KMT2AL3MBTL1SAE1
Hydrochloric Acid SCHEMBL2147064 0.75 CHRM2 (0.68) SMN1; SMN2ALDH1A1RAB9AHTTKDM4E
Hydrochloric Acid SCHEMBL9479560 0.75 CHRM2 (0.68) SMN1; SMN2ALDH1A1RAB9AHTTKDM4E
SCHEMBL2089592 0.74 L3MBTL1 (0.71) SMN1; SMN2LMNAMEN1KMT2AL3MBTL1
SCHEMBL2954416 0.74 L3MBTL1 (0.71) SMN1; SMN2LMNAMEN1KMT2AL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329911-B2 Biphenyl compounds useful as muscarinic receptor antagonists THERAVANCE, INC. (US) 2012-12-11 US disclosed
US-7642355-B2 Bronchodilators; treating chronic obstructive pulmonary disease or asthma; long duration of action; reduced side effects, such as dry-mouth and constipation; e.g. biphenyl-2-ylcarbamic acid 1-(2-(5-[4-(3-dimethylaminopropoxy)benzylamino]pentylcarbamoyl)ethyl)piperidin-4-yl ester THERAVANCE, INC. (US) 2010-01-05 US disclosed
US-20060205779-A1 Biphenyl compounds useful as muscarinic receptor antagonists THERAVANCE, INC. 2006-09-14 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-20060205779-A1 Biphenyl compounds useful as muscarinic receptor antagonists CHRM2, CHRM1, CHRM3 SMN1; SMN2 4327/4885LMNA 2089/4885MEN1 1251/4885

“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.