SCHEMBL915201

SCHEMBL915201

Brc1cc(-c2ccccc2)sc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.52
HSD17B1 P14061 4/20 0.44
PTP4A3 O75365 2/20 0.43
IKBKB O14920 3/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
BTK Q06187 1/20 0.42
PTP4A2 Q12974 1/20 0.41
PTP4A1 Q93096 1/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
PTPN1 P18031 2/20 0.41
LMNA P02545 1/20 0.41
PKM P14618 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
HSD17B2 P37059 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 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
SCHEMBL23447120 0.89 SNCA (0.47) SNCAHSD17B1PTP4A3IKBKBCYP1A2
SCHEMBL14838327 0.89 SNCA (0.47) SNCAHSD17B1PTP4A3IKBKBCYP1A2
SCHEMBL14832743 0.85 SNCA (0.47) SNCAHSD17B1KDM4EMAPTLMNA
SCHEMBL14832797 0.85 SNCA (0.44) SNCAHSD17B1PTP4A3IKBKBCYP1A2
SCHEMBL14838409 0.80 HSD17B1 (0.41) SNCAHSD17B1PTP4A3IKBKBCYP1A2
SCHEMBL3597485 0.79 SNCA (0.53) SNCAHSD17B1IKBKBCYP1A2CYP3A4
SCHEMBL23448488 0.79 SNCA (0.53) SNCAHSD17B1CYP1A2CYP2C9KDM4E
SCHEMBL14832796 0.79 SNCA (0.53) SNCAIKBKBCYP1A2KDM4EMAPT
SCHEMBL23232600 0.79 ALDH1A1 (0.50) SNCAHSD17B1PTP4A3PTP4A2PTP4A1
SCHEMBL6812091 0.77 MAPT (0.40) HSD17B1IKBKBCYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230046046-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-02-16 US disclosed
US-20230046046-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-02-16 US disclosed
EP-4066289-A1 COMPOUNDS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2022-10-05 EP disclosed
CN-108690045-B Diarylethene compounds and uses thereof 首诺加拿大公司 2022-08-30 CN disclosed
CN-114730843-A Compounds for electronic devices 默克专利有限公司 2022-07-08 CN disclosed
US-11124524-B2 Diarylethene compounds and uses thereof SOLUTIA CANADA INC. (US) 2021-09-21 US disclosed
WO-2021104749-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-06-03 WO disclosed
WO-2021104749-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-06-03 WO disclosed
US-10556912-B2 Diarylethene compounds and uses thereof SWITCH MATERIALS, INC. (CA) 2020-02-11 US disclosed
US-20190256526-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2019-08-22 US disclosed
WO-2013044371-A1 PHOTOCHROMIC AND ELECTROCHROMIC DIARYLCYCLOPENTENE DERIVATIVES AS OPTICAL FILTERS SWITCH MATERIALS, INC. (CA) 2013-04-04 WO disclosed
WO-2013044371-A1 PHOTOCHROMIC AND ELECTROCHROMIC DIARYLCYCLOPENTENE DERIVATIVES AS OPTICAL FILTERS SWITCH MATERIALS, INC. (CA) 2013-04-04 WO disclosed
US-20110003966-A1 PHOTOCHROMIC AND ELETROCHROMIC COMPOUNDS AND METHODS OF SYNTHESIZING AND USING SAME SWITCH MATERIALS INC. (CA) 2011-01-06 US disclosed
US-20110003966-A1 PHOTOCHROMIC AND ELETROCHROMIC COMPOUNDS AND METHODS OF SYNTHESIZING AND USING SAME SWITCH MATERIALS INC. (CA) 2011-01-06 US disclosed
US-20110003966-A1 PHOTOCHROMIC AND ELETROCHROMIC COMPOUNDS AND METHODS OF SYNTHESIZING AND USING SAME SWITCH MATERIALS INC. (CA) 2011-01-06 US disclosed
US-7777055-B2 Photochromic and electrochromic compounds and methods of synthesizing and using same SWITCH MATERIALS INC. (CA) 2010-08-17 US disclosed
US-7777055-B2 Photochromic and electrochromic compounds and methods of synthesizing and using same SWITCH MATERIALS INC. (CA) 2010-08-17 US disclosed
US-7777055-B2 Photochromic and electrochromic compounds and methods of synthesizing and using same SWITCH MATERIALS INC. (CA) 2010-08-17 US disclosed
US-20060240197-A1 Photochromic and electrochromic compounds and methods of synthesizing and using same SOLUTIA CANADA INC. (CA) 2006-10-26 US disclosed
WO-2004015024-A1 PHOTOCHROMIC AND ELECTROCHROMIC COMPOUNDS AND METHODS OF SYNTHESIZING AND USING SAME SIMON FRASER UNIVERSITY (CA) 2004-02-19 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 (6 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-20190256526-A1 DIARYLETHENE COMPOUNDS AND USES THEREOF KCNH2, KCNH3, SCN2B SNCA 3283/4885HSD17B1 1685/4885PTP4A3 2139/4885
US-10556912-B2 Diarylethene compounds and uses thereof KCNH2, KCNH3, SCN2B SNCA 3283/4885HSD17B1 1685/4885PTP4A3 2139/4885
US-20230046046-A1 COMPOUNDS FOR ELECTRONIC DEVICES ETV6, CYP2C19, ESR1 SNCA 610/4885HSD17B1 1130/4885PTP4A3 2492/4885
US-20060240197-A1 Photochromic and electrochromic compounds and methods of synthesizing and using same TET1, HMBS, MECP2 SNCA 2555/4885HSD17B1 1962/4885PTP4A3 1565/4885
US-11124524-B2 Diarylethene compounds and uses thereof KCNH2, KCNH3, SCN2B SNCA 3283/4885HSD17B1 1685/4885PTP4A3 2139/4885
US-20110003966-A1 PHOTOCHROMIC AND ELETROCHROMIC COMPOUNDS AND METHODS OF SYNTHESIZING AND USING SAME TET1, MECP2, EYA2 SNCA 3068/4885HSD17B1 2305/4885PTP4A3 2539/4885

“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.