SCHEMBL3098067

SCHEMBL3098067

C=CCCCc1cc[se]c1-c1c(Br)c(C(=O)OCC)nn1-c1ccc(Cl)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
CNR1 P21554 3/20 0.41
SLC5A1 P13866 1/20 0.40
SLC5A2 P31639 1/20 0.40
GABRA2 P47869 2/20 0.39
GABRB2 P47870 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CNR2 P34972 8/20 0.39

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
SCHEMBL3098076 0.81 CNR2 (0.45) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL3735382 0.77 KDM4E (0.49) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL3096383 0.77 KDM4E (0.52) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL923181 0.76 CNR1 (0.61) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL3096389 0.72 KDM4E (0.52) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL3083040 0.72 KDM4E (0.56) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL3098061 0.72 KDM4E (0.58) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL2627954 0.69 CNR1 (0.68) CNR1GABRA2GABRB2CNR2
SCHEMBL30961554 0.69 CNR1 (0.68) CNR1GABRA2GABRB2CNR2
SCHEMBL3745984 0.68 CNR2 (0.45) CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7803799-B2 such as 1-(2,4-dichlorophenyl)-N-(piperidin-1-yl)-5-(selenophen-2-yl)-1H-pyrazole-3-carboxamide, used for treating cannabinoid-receptor mediated disorders selected from obesity, metabolic syndrome, drug abuse and dependence or neuropathic pain NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2010-09-28 US disclosed
US-7799034-B2 Tissue distraction device SPINE WAVE, INC. (US) 2010-09-21 US disclosed
US-20080021031-A1 SELENOPHENE COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTE (TW) 2008-01-24 US disclosed
US-20070179612-A1 Tissue Distraction Device SPINE WAVE, INC. (US) 2007-08-02 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-20080021031-A1 SELENOPHENE COMPOUNDS CNR2, CNR1, SELENOI KDM4E 1250/4885MEN1 1271/4885MAPT 595/4885

“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.