SCHEMBL3100250

SCHEMBL3100250

O=C(Cl)c1cc(-c2ccc[se]2)n(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 1/20 0.54
MARS1 P56192 10/20 0.54
SMPD1 P17405 1/20 0.47
LMNA P02545 3/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CNR1 P21554 1/20 0.45
ALDH1A1 P00352 1/20 0.39
ALOX12 P18054 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PPP1CA P62136 1/20 0.38

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
SCHEMBL3097503 0.90 RPA1 (0.67) RPA1MARS1SMPD1LMNAMEN1
SCHEMBL3088747 0.83 SMPD1 (0.58) RPA1MARS1SMPD1LMNAMEN1
SCHEMBL3092493 0.83 FAAH (0.53) RPA1MARS1LMNAMEN1MAPT
SCHEMBL3095089 0.81 CNR1 (0.53) CNR1
SCHEMBL3087783 0.81 CNR1 (0.73) CNR1
SCHEMBL8197517 0.81 RPA1 (0.80) RPA1MARS1SMPD1LMNAMEN1
SCHEMBL3092456 0.80 CNR1 (0.54) CNR1
SCHEMBL3091499 0.79 CNR1 (0.60) RPA1MARS1SMPD1LMNAMEN1
SCHEMBL3084315 0.75 CNR2 (0.54) CNR1
SCHEMBL1514645 0.72 MARS1 (0.95) RPA1MARS1SMPD1LMNAMAPT

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 2 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-20080021031-A1 SELENOPHENE COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTE (TW) 2008-01-24 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 RPA1 4862/4885MARS1 3841/4885SMPD1 466/4885

“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.