SCHEMBL1128166

SCHEMBL1128166

CCCCCCc1ccc2[nH]c3ccc(CCCCCC)cc3c2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.57
HTR1D P28221 1/20 0.57
HTR1B P28222 1/20 0.57
CTSV O60911 2/20 0.50
CTSL P07711 2/20 0.50
ESR1 P03372 2/20 0.48
ADRA2A P08913 2/20 0.48
ADORA3 P0DMS8 2/20 0.48
TACR2 P21452 2/20 0.48
SLC6A2 P23975 2/20 0.48
SLC6A4 P31645 2/20 0.48
SLC6A3 Q01959 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
SHBG P04278 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
HSPD1 P10809 1/20 0.48
ADRB3 P13945 1/20 0.48

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
SCHEMBL12795553 1.00 HTR1A (0.57) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL31410497 1.00 HTR1A (0.57) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL30304761 1.00 HTR1A (0.57) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL31070057 1.00 HTR1A (0.57) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL12100781 1.00 HTR1A (0.57) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL4581413 1.00 HTR1A (0.57) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL532789 0.98 HTR1A (0.55) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL4323287 0.92 HTR1A (0.54) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL31108179 0.92 HTR1A (0.54) HTR1AHTR1DHTR1BCTSVCTSL
SCHEMBL9163470 0.92 CTSV (0.58) HTR1AHTR1DHTR1BCTSVCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12122748-B2 Optical data communication system comprising para-phenylenevinylenes and specific para-phenylenevinylenes BASF SE (DE) 2024-10-22 US disclosed
EP-3802490-B1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES BASF SE (DE) 2024-09-18 EP disclosed
CN-112272662-B Optical data communication system comprising p-phenylenevinylene and specific p-phenylenevinylene 巴斯夫欧洲公司 2024-07-16 CN disclosed
US-11917899-B2 Arylamine-fluorene alternating copolymer, electroluminescence device material, and electroluminescence device using the polymer SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-02-27 US disclosed
US-20210284608-A1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES BASF SE (DE) 2021-09-16 US disclosed
US-20210284608-A1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES BASF SE (DE) 2021-09-16 US disclosed
US-20210288258-A1 ARYLAMINE-FLUORENE ALTERNATING COPOLYMER, ELECTROLUMINESCENCE DEVICE MATERIAL, AND ELECTROLUMINESCENCE DEVICE USING THE POLYMER SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-09-16 US disclosed
EP-3802490-A1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES BASF SE (DE) 2021-04-14 EP disclosed
CN-112272662-A Optical data communication system comprising p-phenylethene and specific p-phenylethene 巴斯夫欧洲公司 2021-01-26 CN disclosed
US-20200212306-A1 QUANTUM DOT ELECTROLUMINESCENCE DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-07-02 US disclosed
EP-2711949-A1 Compounds having hole conducting property, co-adsorbent body comprising same, and dye-sensitized solar cell comprising the co-adsorbent body Korea University Research and Business Foundation (KR) 2014-03-26 EP disclosed
EP-2711949-A1 Compounds having hole conducting property, co-adsorbent body comprising same, and dye-sensitized solar cell comprising the co-adsorbent body Korea University Research and Business Foundation (KR) 2014-03-26 EP disclosed
EP-2711359-A1 Compounds having hole conducting property, co-adsorbent body comprising same, and dye-sensitized solar cell comprising the co-adsorbent body Korea University Research and Business Foundation (KR) 2014-03-26 EP disclosed
EP-2711359-A1 Compounds having hole conducting property, co-adsorbent body comprising same, and dye-sensitized solar cell comprising the co-adsorbent body Korea University Research and Business Foundation (KR) 2014-03-26 EP disclosed
US-20140034623-A1 SWITCHABLE SPECIAL EFFECT SUBSTANCES BASF SE (DE) 2014-02-06 US disclosed
EP-2283021-B1 SWITCHABLE SPECIAL EFFECT SUBSTANCES BASF SE (DE) 2014-01-08 EP disclosed
US-8586745-B2 Switchable special effect substances BASF SE (DE) 2013-11-19 US disclosed
US-20110060113-A1 SWITCHABLE SPECIAL EFFECT SUBSTANCES BASF SE (DE) 2011-03-10 US disclosed
EP-2283021-A2 SWITCHABLE SPECIAL EFFECT SUBSTANCES BASF SE (DE) 2011-02-16 EP disclosed
WO-2009141288-A2 SWITCHABLE SPECIAL EFFECT SUBSTANCES BASF SE (DE) 2009-11-26 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 (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-12122748-B2 Optical data communication system comprising para-phenylenevinylenes and specific para-phenylenevinylenes OR10J3, OXER1, CDC73 HTR1A 2618/4885HTR1D 2628/4885HTR1B 3374/4885
US-20210284608-A1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES OR10J3, OXER1, CDC73 HTR1A 2618/4885HTR1D 2628/4885HTR1B 3374/4885
US-20110060113-A1 SWITCHABLE SPECIAL EFFECT SUBSTANCES PPARG, PTGER4, NR2E3 HTR1A 2623/4885HTR1D 1932/4885HTR1B 1800/4885

“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.