SCHEMBL3373971

SCHEMBL3373971

O=c1ccc2cc(OCc3ccccc3)ccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.65
ACHE P22303 1/20 0.65
KDM4E B2RXH2 1/20 0.63
ALDH1A1 P00352 1/20 0.63
CYP1A2 P05177 1/20 0.63
CYP2C9 P11712 1/20 0.63
HPGD P15428 1/20 0.63
SRD5A2 P31213 1/20 0.63
HSD17B10 Q99714 1/20 0.63
PDGFRB P09619 1/20 0.62
PDGFRA P16234 1/20 0.62
ALOX5 P09917 1/20 0.61
FLT3 P36888 1/20 0.58
PDE3B Q13370 1/20 0.56
PDE3A Q14432 1/20 0.56
MAOA P21397 4/20 0.54
NSD2 O96028 1/20 0.54
ABL1 P00519 1/20 0.54
PPARG P37231 1/20 0.54
RIN1 Q13671 1/20 0.54

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
SCHEMBL30507458 0.90 MAOB (0.79) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL7654099 0.90 MAOB (0.79) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL14818908 0.86 F11 (0.58) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL14846414 0.86 MAOB (0.53) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL31722407 0.82 MAOB (0.57) MAOBACHEKDM4EHPGDPDE3B
SCHEMBL7306333 0.79 ALDH1A1 (0.49) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL21864824 0.79 KDM4E (0.62) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL5143597 0.79 MAOB (0.65) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL14801098 0.79 TERT (0.47) MAOBACHEKDM4EALDH1A1CYP1A2
SCHEMBL8860906 0.79 DRD2 (0.59) MAOBACHEKDM4EMAOAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140024583-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-01-23 US disclosed
CN-101460476-B Organic compounds NOVARTIS AG 2013-12-04 CN disclosed
US-8501746-B2 Organic compounds XENON PHARMACEUTICALS INC. (CA) 2013-08-06 US disclosed
WO-2007143597-A9 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-11 WO disclosed
EP-2029572-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-03 EP disclosed
US-20090156615-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-06-18 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 (2 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-20090156615-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 MAOB 510/4885ACHE 639/4885KDM4E 683/4885
US-20140024583-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 MAOB 510/4885ACHE 639/4885KDM4E 683/4885

“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.