SCHEMBL196200

SCHEMBL196200

CCCCCCCCC(C)C#N

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
OPRM1 P35372 1/20 0.44
SPHK1 Q9NYA1 1/20 0.41
LMNA P02545 1/20 0.41
DNM1 Q05193 2/20 0.40
THRB P10828 1/20 0.40
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
ACE2 Q9BYF1 1/20 0.38
GPR84 Q9NQS5 1/20 0.37

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
SCHEMBL15638673 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL31338794 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL663207 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL28695900 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL5495726 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL25252646 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL9787863 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL20725833 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL22263515 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1
SCHEMBL27697767 1.00 TSHR (0.48) TSHROPRM1SPHK1LMNADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12589377-B2 Encapsulated composition comprising core-shell microcapsules and process for its preparation GIVAUDAN SA (CH) 2026-03-31 US claimed
EP-4695016-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2026-02-18 EP claimed
EP-4581114-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Novozymes A/S (DK) 2025-07-09 EP claimed
EP-4096618-B1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2025-01-29 EP claimed
WO-2024213507-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2024-10-17 WO claimed
EP-4446001-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2024-10-16 EP claimed
EP-4438065-A2 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2024-10-02 EP claimed
WO-2024046952-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS NOVOZYMES A/S (DK) 2024-03-07 WO claimed
US-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2024-02-15 US claimed
US-20240050335-A1 A SYNERGISTIC PERFUMING COMPOSITION FIRMENICH & CIE (CH) 2024-02-15 US claimed
WO-2002081614-A1 PERFUME COMPOSITIONS QUEST INTERNATIONAL B.V. (NL) 2002-10-17 WO claimed
EP-1021511-A1 STABLE FRAGRANCES FOR BLEACHING COMPOUNDS Bush Boake Allen Inc. (US) 2000-07-26 EP claimed
WO-1999057233-A1 PERFUME COMPOSITION QUEST INTERNATIONAL B.V. (NL) 1999-11-11 WO claimed
US-5972864-A BLEACHING BLOCK; MIXTURE OF BLEACH AND ORGANOLEPTIC COMPOUND LONZA INC. (US) 1999-10-26 US claimed
US-5942153-A A SHAPED STABLE BLOCK COMPRISING AN ORGANOLEPTIC FRAGRANT AGENT AND BLEACHING AGENT; FRAGRANT AGENT DOES NOT DECOMPOSE THE BLEACHING AGENT, NOT HYGROSCOPIC; USE IN VENTILATING HOOD AS PROTECTIVE GLOVES, A DUST MASK, AND GOGGLES BUSH BOAKE ALLEN INC. (US) 1999-08-24 US claimed
WO-1998006804-A1 STABLE FRAGRANCES FOR BLEACHING COMPOUNDS BUSH BOAKE ALLEN INC. (US) 1998-02-19 WO claimed
EP-0299561-B1 Perfume and bleach compositions UNILEVER NV (NL) 1996-01-10 EP claimed
WO-1993021295-A1 LIQUID OR GEL BLEACHING COMPOSITION CONTAINING AMIDOPEROXYACID BLEACH AND PERFUME THE PROCTER & GAMBLE COMPANY (US) 1993-10-28 WO 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
US-5234617-A Cleaning, bleaching fabrics Hunter, Kathleen B. (US) 1993-08-10 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 (2 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-12589377-B2 Encapsulated composition comprising core-shell microcapsules and process for its preparation CUTA, EXOC1, EXOSC10 TSHR 2858/4885OPRM1 2435/4885SPHK1 4525/4885
US-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS OR10J3, OR51E2, MAL2 TSHR 4469/4885OPRM1 6/4885SPHK1 3528/4885

“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.