SCHEMBL8295301

SCHEMBL8295301

C=C(C)/C=C\c1ccccc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.37
▸ CYP3A4 P08684 3/20 0.35
▸ ALOX15 P16050 2/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NFE2L2 Q16236 3/20 0.34
▸ NFKB1 P19838 2/20 0.34
▸ JUN P05412 1/20 0.34
▸ IAPP P10997 1/20 0.34
▸ TFEB P19484 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ GSR P00390 1/20 0.33
▸ BCHE P06276 1/20 0.33

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
SCHEMBL8661727 0.85 MAPT (0.47) MAPTLMNAKDM4ECYP3A4ALOX15
SCHEMBL24425997 0.83 CYP3A4 (0.45) MAPTLMNAKDM4ECYP3A4IAPP
SCHEMBL31310317 0.80 MAPT (0.63) MAPTLMNAKDM4ESMN1; SMN2NFE2L2
SCHEMBL12569874 0.80 MAPT (0.63) MAPTLMNAKDM4ESMN1; SMN2NFE2L2
SCHEMBL14257702 0.79 NFE2L2 (0.40) MAPTLMNAKDM4ECYP3A4NFE2L2
SCHEMBL8349013 0.78 TSHR (0.45) MAPTLMNAKDM4ESMN1; SMN2NFE2L2
SCHEMBL2961735 0.78 TSHR (0.45) MAPTLMNAKDM4ESMN1; SMN2NFE2L2
SCHEMBL10962113 0.78 MAPT (0.66) MAPTLMNAKDM4ENFE2L2NFKB1
SCHEMBL13680308 0.76 LMNA (0.52) MAPTLMNAKDM4ESMN1; SMN2NFE2L2
SCHEMBL16507826 0.76 CD44 (0.41) MAPTLMNAKDM4EIAPPALDH1A1

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-20170012224-A1 PLATINUM COMPLEXES AND DEVICES ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2017-01-12 — — US disclosed
EP-1869025-B3 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS OTSUKA PHARMA CO LTD (JP) 2016-08-31 — — EP disclosed
EP-1869025-B1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS OTSUKA PHARMA CO LTD (JP) 2011-01-26 — — EP disclosed
US-20100178654-A1 REAGENT AND REAGENT KIT FOR ANALYSIS OF IMMATURE LEUKOCYTE SYSMEX CORPORATION (JP) 2010-07-15 — — US disclosed
EP-2067767-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-06-10 — — EP disclosed
WO-2005013947-A2 MEANS AND METHODS FOR TREATING A DISEASE WHICH IS ASSOCIATED WITH AN EXCESS TRANSPORT OF HYALURONAN ACROSS A LIPID BILAYER Universitätsklinikum Münster (DE) 2005-02-17 — — WO 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-20170012224-A1 PLATINUM COMPLEXES AND DEVICES OXA1L, OCIAD1, OCIAD2 MAPT 1431/4885LMNA 3998/4885KDM4E 4835/4885

“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.

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