SCHEMBL10002017

SCHEMBL10002017

FC1(F)C(c2cc(-c3ccccc3)sc2-c2ccccc2)=C(c2cc(-c3ccc(Cl)cc3)sc2-c2ccccc2)C(F)(F)C1(F)F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.41
PTP4A3 O75365 2/20 0.40
ESR1 P03372 3/20 0.40
ESR2 Q92731 1/20 0.40
PTP4A2 Q12974 1/20 0.39
PTP4A1 Q93096 1/20 0.39
CYP1A2 P05177 2/20 0.38
HSD17B2 P37059 1/20 0.37
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
EGFR P00533 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KDR P35968 1/20 0.32
MAP4K4 O95819 1/20 0.32
IKBKB O14920 1/20 0.32

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
SCHEMBL14838335 0.94 ESR1 (0.44) HSD17B1PTP4A3ESR1ESR2PTP4A2
SCHEMBL916777 0.91 HSD17B1 (0.47) HSD17B1PTP4A3ESR1ESR2PTP4A2
SCHEMBL14838323 0.86 HSD17B1 (0.41) HSD17B1PTP4A3ESR1ESR2PTP4A2
SCHEMBL21291302 0.85 HSD17B1 (0.32) HSD17B1PTP4A3PTP4A2PTP4A1
SCHEMBL14838368 0.84 ESR1 (0.36) HSD17B1ESR1ESR2CYP1A2HSD17B2
SCHEMBL16021787 0.84 HSD17B1 (0.40) HSD17B1PTP4A3ESR1ESR2PTP4A2
SCHEMBL19979600 0.83 MAPT (0.34) HSD17B1PTP4A3ESR1ESR2NPC1
SCHEMBL14838322 0.83 HSD17B1 (0.43) HSD17B1PTP4A3ESR1ESR2PTP4A2
SCHEMBL14838329 0.83 HSD17B1 (0.39) HSD17B1PTP4A3ESR1ESR2PTP4A2
SCHEMBL14838518 0.83 HSD17B1 (0.42) HSD17B1PTP4A3ESR1ESR2PTP4A2

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108690045-B Diarylethene compounds and uses thereof 首诺加拿大公司 2022-08-30 CN disclosed
US-10556912-B2 Diarylethene compounds and uses thereof SWITCH MATERIALS, INC. (CA) 2020-02-11 US disclosed
US-20200033687-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MAT INC (CA) 2020-01-30 US disclosed
US-10416521-B2 Variable transmittance optical filter and uses thereof SWITCH MATERIALS, INC. (CA) 2019-09-17 US disclosed
EP-3385354-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF Switch Materials, Inc. (CA) 2018-10-10 EP disclosed
US-20180210308-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SOLUTIA CANADA INC. (CA) 2018-07-26 US disclosed
US-20180210308-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SOLUTIA CANADA INC. (CA) 2018-07-26 US disclosed
EP-2760969-B1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MAT INC (CA) 2018-05-16 EP disclosed
US-9864252-B2 Variable transmittance optical filter and uses thereof SWITCH MATERIALS, INC. (CA) 2018-01-09 US disclosed
US-20160083398-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2016-03-24 US disclosed
US-20140256936-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2014-09-11 US disclosed
US-20140256936-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2014-09-11 US disclosed
US-20130208333-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2013-08-15 US disclosed
US-8441707-B2 Variable transmittance optical filter and uses thereof SWITCH MATERIALS, INC. (CA) 2013-05-14 US disclosed
US-8441707-B2 Variable transmittance optical filter and uses thereof SWITCH MATERIALS, INC. (CA) 2013-05-14 US disclosed
WO-2013044371-A1 PHOTOCHROMIC AND ELECTROCHROMIC DIARYLCYCLOPENTENE DERIVATIVES AS OPTICAL FILTERS SWITCH MATERIALS, INC. (CA) 2013-04-04 WO disclosed
US-20120044560-A9 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2012-02-23 US disclosed
US-20120044560-A9 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2012-02-23 US disclosed
US-20100315693-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2010-12-16 US disclosed
US-20100315693-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2010-12-16 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 (3 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-10556912-B2 Diarylethene compounds and uses thereof KCNH2, KCNH3, SCN2B HSD17B1 1685/4885PTP4A3 2139/4885ESR1 1818/4885
US-20140256936-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF KCNH2, KCNH3, SCN2B HSD17B1 1685/4885PTP4A3 2139/4885ESR1 1818/4885
US-20160083398-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF KCNH2, KCNH3, SCN2B HSD17B1 1685/4885PTP4A3 2139/4885ESR1 1818/4885

“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.