SCHEMBL972607

SCHEMBL972607

CCCCCCCCCC(C)CC#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
ACE2 Q9BYF1 1/20 0.44
OPRM1 P35372 1/20 0.41
SPHK1 Q9NYA1 1/20 0.39
LMNA P02545 1/20 0.38
DNM1 Q05193 2/20 0.37
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
THRB P10828 1/20 0.36
PRKD3 O94806 1/20 0.35
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCH P24723 1/20 0.35
PRKCI P41743 1/20 0.35
PRKCE Q02156 1/20 0.35
PRKCQ Q04759 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
SCHEMBL11967103 1.00 TSHR (0.44) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL2575431 1.00 TSHR (0.44) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL29776832 1.00 TSHR (0.44) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL28272375 1.00 TSHR (0.44) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL10526307 1.00 TSHR (0.44) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL29776834 1.00 TSHR (0.44) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL22296672 0.98 ACE2 (0.47) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL7950449 0.98 TSHR (0.46) TSHRACE2OPRM1SPHK1LMNA
SCHEMBL4202857 0.91
SCHEMBL4202851 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11364184-B2 Perfume compositions GIVAUDAN SA (CH) 2022-06-21 US claimed
WO-2018145219-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ADDICTIONS BY MEANS OF AVERSIVE COUNTERCONDITIONING SERANI MOSTAZAL JORGE (CL) 2018-08-16 WO claimed
EP-1869150-B2 PERFUME COMPOSITIONS GIVAUDAN SA (CH) 2016-08-31 EP claimed
US-20140235520-A1 Perfume Compositions GIVAUDAN NEDERLAND SERVICES B.V. (NL) 2014-08-21 US claimed
EP-1869150-B1 PERFUME COMPOSITIONS GIVAUDAN NEDERLAND SERVICES BV (NL) 2012-05-30 EP claimed
US-20110182832-A1 PERFUME COMPOSITIONS QUEST INTERNATIONAL SERVICES B.V. (NL) 2011-07-28 US claimed
US-20110020251-A1 Ultraviolet-Absorbing Compounds AVOCA LLC 2011-01-27 US claimed
EP-1948773-A1 FRAGRANT CONSUMER PRODUCTS COMPRISING OXIDIZING AGENTS Henkel AG & Co. KGaA (DE) 2008-07-30 EP claimed
EP-1869150-A1 PERFUME COMPOSITIONS Quest International Services B.V. (NL) 2007-12-26 EP claimed
WO-2007054177-A1 FRAGRANT CONSUMER PRODUCTS COMPRISING OXIDIZING AGENTS HENKEL AG & CO. KGAA (DE) 2007-05-18 WO claimed
WO-2006109078-A1 PERFUME COMPOSITIONS QUEST INTERNATIONAL SERVICES B.V. (NL) 2006-10-19 WO claimed
US-20040116325-A1 Perfume compositions QUEST INTERNATIONAL SERVICES B.V. (NL) 2004-06-17 US claimed
WO-2002081614-A1 PERFUME COMPOSITIONS QUEST INTERNATIONAL B.V. (NL) 2002-10-17 WO claimed
EP-0299561-B1 Perfume and bleach compositions UNILEVER NV (NL) 1996-01-10 EP claimed
WO-1993021296-A1 AQUEOUS LIQUID BLEACH COMPOSITIONS WITH FLUORESCENT WHITENING AGENT AND POLYVINYL PYRROLIDONE OR POLYVINYL ALCOHOL THE PROCTER & GAMBLE COMPANY (US) 1993-10-28 WO claimed
WO-1993021295-A1 LIQUID OR GEL BLEACHING COMPOSITION CONTAINING AMIDOPEROXYACID BLEACH AND PERFUME THE PROCTER & GAMBLE COMPANY (US) 1993-10-28 WO claimed
US-5234617-A Cleaning, bleaching fabrics Hunter, Kathleen B. (US) 1993-08-10 US claimed
EP-4695016-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2026-02-18 EP disclosed
US-5234617-A Cleaning, bleaching fabrics Hunter, Kathleen B. (US) 1993-08-10 US disclosed
US-4923631-A MONOPERSULFATE SALTS AND-OR ORGANIC PEROXYACIDS LEVER BROTHERS COMPANY (US) 1990-05-08 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 (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-20110020251-A1 Ultraviolet-Absorbing Compounds UFM1, UHRF1, CUTA TSHR 2543/4885ACE2 3522/4885OPRM1 3078/4885

“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.