SCHEMBL14838239

SCHEMBL14838239

COCCOCC(COCCOC)(COCCOC)COc1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.40
DRD4 P21917 6/20 0.40
DRD3 P35462 6/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
ACHE P22303 1/20 0.38
NPC1 O15118 3/20 0.37
KDM4E B2RXH2 1/20 0.37
RECQL P46063 1/20 0.37
WDR5 P61964 1/20 0.36
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
KCNH2 Q12809 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL15025997 0.83 DRD2 (0.47) DRD2DRD4DRD3L3MBTL1ACHE
SCHEMBL16021744 0.82 KMT2A (0.40) L3MBTL1NPC1KDM4ERECQLRAB9A
SCHEMBL14280611 0.81 KDM4E (0.37) KDM4ERECQLKMT2ALMNA
SCHEMBL14280606 0.80 KDM4E (0.36) KDM4ERECQLKMT2ALMNA
SCHEMBL10042114 0.80 KDM4E (0.54) DRD2DRD4DRD3L3MBTL1ACHE
SCHEMBL20234188 0.80 KDM4E (0.54) DRD2DRD4DRD3L3MBTL1ACHE
SCHEMBL13645868 0.80 DRD2 (0.46) DRD2DRD4DRD3L3MBTL1ACHE
SCHEMBL21897674 0.80 KDM4E (0.54) DRD2DRD4DRD3L3MBTL1ACHE
SCHEMBL15585749 0.80 KDM4E (0.54) DRD2DRD4DRD3L3MBTL1ACHE
SCHEMBL12835053 0.80 KDM4E (0.54) DRD2DRD4DRD3L3MBTL1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160083398-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2016-03-24 US disclosed
US-9227986-B2 Diarylethene compounds and uses thereof SWITCH MATERIALS, INC. (CA) 2016-01-05 US disclosed
US-20150036204-A1 OPTICAL FILTER WITH LIGHT SOURCE SWITCH MATERIALS, INC. (CA) 2015-02-05 US disclosed
US-20140256936-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2014-09-11 US disclosed
WO-2013123592-A1 OPTICAL FILTER WITH LIGHT SOURCE SWITCH MATERIALS INC. (CA) 2013-08-29 WO disclosed
WO-2013106921-A1 COMPOSITE OPTICAL FILTER SWITCH MATERIALS , INC. (CA) 2013-07-25 WO disclosed
WO-2013044371-A1 PHOTOCHROMIC AND ELECTROCHROMIC DIARYLCYCLOPENTENE DERIVATIVES AS OPTICAL FILTERS SWITCH MATERIALS, INC. (CA) 2013-04-04 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 (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-20140256936-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF KCNH2, KCNH3, SCN2B DRD2 417/4885DRD4 486/4885DRD3 665/4885
US-20160083398-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF KCNH2, KCNH3, SCN2B DRD2 417/4885DRD4 486/4885DRD3 665/4885

“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.