SCHEMBL167733

SCHEMBL167733

CCCCc1cccc(C)c1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.61
LPL P06858 2/20 0.50
LIPG Q9Y5X9 2/20 0.50
HRH3 Q9Y5N1 1/20 0.50
NPC1 O15118 1/20 0.50
HPGD P15428 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
SKP2 Q13309 1/20 0.50
IDO1 P14902 2/20 0.48
ACHE P22303 1/20 0.46
DAO P14920 1/20 0.45

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
SCHEMBL30869992 1.00 TAAR1 (0.61) TAAR1LPLLIPGHRH3NPC1
SCHEMBL598872 0.94 TAAR1 (0.59) TAAR1LPLLIPGHRH3
SCHEMBL8096717 0.92 TAAR1 (0.53) TAAR1LPLLIPGHRH3NPC1
SCHEMBL28041371 0.92 LPL (0.59) TAAR1LPLLIPG
SCHEMBL105418 0.92 LPL (0.59) TAAR1LPLLIPG
SCHEMBL11069727 0.92 LPL (0.59) TAAR1LPLLIPG
SCHEMBL8780379 0.92 LPL (0.59) TAAR1LPLLIPG
SCHEMBL9485795 0.92 LPL (0.59) TAAR1LPLLIPG
SCHEMBL11073651 0.92 LPL (0.59) TAAR1LPLLIPG
Bicarbonate SCHEMBL28813992 0.91 TAAR1 (0.52) TAAR1LPLLIPGNPC1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108699086-A Metal complex UEA企业有限公司 2018-10-23 CN claimed
US-9120715-B2 Alkylation of aromatic substrates TOTAL PETROCHEMICALS FRANCE (FR) 2015-09-01 US claimed
US-20140206917-A1 Alkylation of Aromatic Substrates TOTAL PETROCHEMICALS FRANCE (FR) 2014-07-24 US claimed
US-8466333-B2 Process of making alkylaromatics using EMM-12 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-06-18 US claimed
EP-2134815-B1 IMPROVED ALKYLAROMATIC PRODUCTION PROCESS EXXONMOBIL CHEM PATENTS INC (US) 2013-05-01 EP claimed
US-8217213-B2 Hydroalkylation of aromatic compounds using EMM-12 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-07-10 US claimed
US-8212096-B2 Hydroalkylation of aromatic compounds using EMM-13 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-07-03 US claimed
US-8198496-B2 Process of making alkylaromatics using EMM-13 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-06-12 US claimed
US-20120046509-A1 Process of Making Alkylaromatics Using EMM-12 EXXONMOBI CHEMICAL PATENTS INC. 2012-02-23 US claimed
JP-2011529890-A 2011-12-15 JP claimed
WO-2010014404-A1 PROCESS OF MAKING ALKYLAROMATICS USING EMM-13 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-02-04 WO claimed
WO-2010014402-A1 HYDROALKYLATION OF AROMATIC COMPOUNDS USING EMM-12 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-02-04 WO claimed
WO-2010014401-A1 HYDROALKYLATION OF AROMATIC COMPOUNDS USING EMM-13 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-02-04 WO claimed
EP-2134815-A1 IMPROVED ALKYLAROMATIC PRODUCTION PROCESS Exxonmobil Chemical Patents Inc. A Corporation Of The State Of Delaware (US) 2009-12-23 EP claimed
WO-2008097737-A1 IMPROVED ALKYLAROMATIC PRODUCTION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. A CORPORATION OF THE STATE OF DELAWARE (US) 2008-08-14 WO claimed
US-20080194897-A1 Alkylaromatic Production Process EXXONMOBIL CHEMICAL PATENTS INC. 2008-08-14 US claimed
EP-1150565-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION bioscience AG (DE) 2001-11-07 EP claimed
WO-2000045635-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2000-08-10 WO claimed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP claimed
US-5073655-A Alkylation of aromatic hydrocarbon with aromatic alklating hal ide, alcohol or olefin, a mixed oxide of silica or germania wi th alumina, boria, iron oxide or gallium oxide MOBIL OIL CORP. (US) 1991-12-17 US claimed

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-20120046509-A1 Process of Making Alkylaromatics Using EMM-12 CASP12, RBM12, MDM4 TAAR1 3368/4885LPL 4730/4885LIPG 3655/4885

“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.