SCHEMBL97559

SCHEMBL97559

CC(C=O)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.60
TSHR P16473 1/20 0.60
TAAR1 Q96RJ0 5/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
SIGMAR1 Q99720 4/20 0.52
SLC6A2 P23975 2/20 0.52
MAOA P21397 1/20 0.52
SLC6A4 P31645 1/20 0.52
SLC6A3 Q01959 1/20 0.52
CYP2A6 P11509 1/20 0.52
ADORA2A P29274 1/20 0.52
ADORA1 P30542 1/20 0.52
EPHX1 P07099 2/20 0.50
SLC18A2 Q05940 1/20 0.48
CYP2D6 P10635 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TRPA1 O75762 1/20 0.47
CYP1A2 P05177 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
SCHEMBL286217 1.00 TP53 (0.60) TP53TSHRTAAR1MEN1KMT2A
SCHEMBL3484487 1.00 TP53 (0.60) TP53TSHRTAAR1MEN1KMT2A
SCHEMBL11461422 0.92 TP53 (0.58) TP53TSHRTAAR1MEN1KMT2A
SCHEMBL159574 0.88 TP53 (0.58) TP53TSHRTAAR1MEN1KMT2A
SCHEMBL8283176 0.88 TP53 (0.58) TP53TSHRTAAR1MEN1KMT2A
SCHEMBL7931783 0.84 TAAR1 (0.50) TP53TSHRTAAR1MEN1KMT2A
SCHEMBL11439830 0.83 TP53 (0.53) TP53TSHR
SCHEMBL7830613 0.83 CSNK1E (0.50) TP53TSHRTAAR1MEN1KMT2A
SCHEMBL26082413 0.83 MAOB (0.56) SIGMAR1MAOA
SCHEMBL31412811 0.82 TSHR (0.66) TP53TSHRMEN1KMT2AEPHX1

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 1067 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897423-A Stabilized poly (alkylaldehydes) 博伊西州立大学 2024-04-16 CN claimed
CN-117384713-A Laundry detergent composition comprising graft copolymer and benefit agent 宝洁公司 2024-01-12 CN claimed
US-20240010954-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT THE PROCTER & GAMBLE COMPANY 2024-01-11 US claimed
CN-112266823-A Essence for soap 厦门馨米兰香精香料有限公司 2021-01-26 CN claimed
CN-112266821-A Essence for grain germ laundry detergent 厦门馨米兰香精香料有限公司 2021-01-26 CN claimed
CN-112266822-A Essence for laundry detergent 厦门馨米兰香精香料有限公司 2021-01-26 CN claimed
EP-3713921-A1 HYDROLYTICALLY LABILE HETEROCYCLES OF ODORIFEROUS KETONES OR ODORIFEROUS ALDEHYDES Henkel AG & Co. KGaA (DE) 2020-09-30 EP 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
CN-1989235-B Composition comprising a metal oxide and a metal oxide GIVAUDAN SA 2012-12-19 CN claimed
EP-2366014-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2011-09-21 EP claimed
WO-2001018145-A2 ELECTROSTATIC AEROSOL COMPOSITIONS RECKITT BENCKISER (UK) LIMITED (GB) 2001-03-15 WO claimed
WO-2000018897-A1 LAUNDRY DETERGENT AND/OR FABRIC CARE COMPOSITIONS COMPRISING CHEMICAL COMPONENTS LINKED TO A CELLULOSE BINDING DOMAIN THE PROCTER & GAMBLE COMPANY (US) 2000-04-06 WO claimed
US-5817757-A AUTOIMMUNE DISORDERS, OLIGOPEPTIDE DERIVATIVES MERCK & CO., INC. (US) 1998-10-06 US claimed
EP-0610892-B1 Method of reducing malodors in permanent waving ZOTOS INT INC (US) 1997-07-30 EP claimed
US-5554363-A Method of reducing malodors in permanent waving HELENE CURTIS, INC. (US) 1996-09-10 US claimed
EP-0610892-A1 Method of reducing malodors in permanent waving HELENE CURTIS, INC. (US) 1994-08-17 EP claimed
US-4616086-A ANTICOAGULANTS BOEHRINGER MANNHEIM GMBH (DE) 1986-10-07 US claimed
US-4568772-A ALKYLATING PROTECTED ALDEHYDE COMPOUND, REMOVING PROTECTING GROUP GIVAUDAN CORPORATION (US) 1986-02-04 US claimed
EP-0076996-B1 CARBOXYLIC-ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM Roche Diagnostics GmbH (DE) 1986-01-02 EP claimed
EP-0103896-B1 PROCESS FOR THE PRODUCTION OF AN ARALIPHATIC ALDEHYDE, AND AGENTS FOR ITS PRODUCTION L. GIVAUDAN & CIE Société Anonyme (CH) 1985-07-17 EP claimed