SCHEMBL3366397

SCHEMBL3366397

CCCCC(C=O)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CTSK P43235 12/20 0.51
CTSL P07711 5/20 0.51
CTSB P07858 5/20 0.51
CTSH P09668 2/20 0.51
CSNK1E P49674 1/20 0.44
CNR2 P34972 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
EPHX1 P07099 1/20 0.42

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
SCHEMBL1827653 0.95 CSNK1E (0.50) TSHRSMN1; SMN2CTSKCTSLCTSB
SCHEMBL18315865 0.93 CSNK1E (0.53) TSHRSMN1; SMN2CTSKCTSLCTSB
SCHEMBL10629707 0.93 CSNK1E (0.53) TSHRSMN1; SMN2CTSKCTSLCTSB
SCHEMBL25457813 0.93 CSNK1E (0.53) TSHRSMN1; SMN2CTSKCTSLCTSB
SCHEMBL14149558 0.93 CSNK1E (0.53) TSHRSMN1; SMN2CTSKCTSLCTSB
SCHEMBL1546515 0.89 TAAR1 (0.46) CTSKCTSLCTSBCTSHMEN1
SCHEMBL7279393 0.84 ACE (0.45) SMN1; SMN2EPHX1
SCHEMBL14690339 0.82 CSNK1E (0.44) CTSKCTSLCTSBCTSHCSNK1E
SCHEMBL9542385 0.82 HTR2A (0.46) SMN1; SMN2MEN1KMT2ATAAR1EPHX1
Butylbenzyl SCHEMBL28237241 0.81 TSHR (0.61) TSHRSMN1; SMN2CTSKCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023196616-A1 FRAGRANCE AND FLAVOR MATERIALS TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2023-10-12 WO disclosed
US-11062794-B2 Olfactory signature and odorant mixture having the same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2021-07-13 US disclosed
US-20180253534-A1 OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-09-06 US disclosed
EP-3325707-A1 COMPOSITIONS FOR MALODOR REDUCTION AND USE THEREOF Agilex Flavors & fragrances, Inc. (US) 2018-05-30 EP disclosed
US-9959392-B2 Olfactory signature and odorant mixture having the same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-05-01 US disclosed
EP-3280496-A1 EXTENDED LONGEVITY FRAGRANCE DELIVERY COMPOSITION Momentive Performance Materials Inc. (US) 2018-02-14 EP disclosed
WO-2017015173-A1 COMPOSITIONS FOR MALODOR REDUCTION AND USE THEREOF AGILEX FLAVORS & FRAGRANCES, INC. (US) 2017-01-26 WO disclosed
WO-2016164421-A1 EXTENDED LONGEVITY FRAGRANCE DELIVERY COMPOSITION MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2016-10-13 WO disclosed
US-8961946-B2 Hair processing agent and method for permanent waving hair SHOWA DENKO K.K. (JP) 2015-02-24 US disclosed
US-20140221269-A1 OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2014-08-07 US disclosed
WO-2006048526-A2 NON-IRRITATING RAPID-ACTION DEPILATORY COMPOSITION PRODUCCIONES INFOVISION (MX) 2006-05-11 WO disclosed
US-20050020459-A1 Carrier solution for cleaning purposes or topical applying SOLARBRE, INC. 2005-01-27 US disclosed
US-5401722-A Peptide analogues MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-03-28 US disclosed
EP-0501280-A2 Renin-inhibiting peptide analogues MERCK PATENT GmbH (DE) 1992-09-02 EP disclosed
EP-0446485-A2 Peptide analogues with renininhibiting activity MERCK PATENT GmbH (DE) 1991-09-18 EP disclosed
EP-0339483-A2 Renin inhbiting amino-acid derivatives MERCK PATENT GmbH (DE) 1989-11-02 EP disclosed
EP-0338168-A1 Phosphonoalkylpurine derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1989-10-25 EP disclosed
EP-0292800-A2 Amino acid derivatives MERCK PATENT GmbH (DE) 1988-11-30 EP disclosed
EP-0249096-A2 Renin-inhibiting amino acid derivatives MERCK PATENT GmbH (DE) 1987-12-16 EP disclosed
US-4087549-A Sulphonic acid containing indenyl derivatives MERCK & CO., INC. (US) 1978-05-02 US disclosed