SCHEMBL515423

SCHEMBL515423

C/C=C(/CC)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
CES2 O00748 2/20 0.46
CES1 P23141 2/20 0.46
ESR1 P03372 3/20 0.42
ESR2 Q92731 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC3 O15379 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
CYP19A1 P11511 1/20 0.41
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39

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
SCHEMBL6027480 1.00 ATM (0.48) ATMCES2CES1ESR1ESR2
SCHEMBL515424 1.00 ATM (0.48) ATMCES2CES1ESR1ESR2
SCHEMBL498532 0.83 ATM (0.52) ATMCES2CES1ESR1ESR2
SCHEMBL7803887 0.81 CES2 (0.50) ATMCES2CES1ESR1HDAC1
SCHEMBL16787362 0.81 ATM (0.45) ATMCES2CES1ESR1ESR2
SCHEMBL17188467 0.81 MAOA (0.57) ATMCES2CES1ESR1ESR2
SCHEMBL17188465 0.81 ATM (0.45) ATMCES2CES1ESR1ESR2
SCHEMBL22567026 0.81 ATM (0.45) ATMCES2CES1ESR1ESR2
SCHEMBL6159704 0.81 ATM (0.45) ATMCES2CES1ESR1ESR2
SCHEMBL7803886 0.81 CES2 (0.50) ATMCES2CES1ESR1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240044832-A1 METHODS FOR DIAGNOSING CANCER BASED ON VOLATILE ORGANIC COMPOUNDS IN BLOOD AND URINE SAMPLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LIMITED (IL) 2024-02-08 US claimed
EP-4264260-A1 METHODS FOR DIAGNOSING CANCER BASED ON VOLATILE ORGANIC COMPOUNDS IN BLOOD AND URINE SAMPLES TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) 2023-10-25 EP claimed
WO-2022137232-A1 METHODS FOR DIAGNOSING CANCER BASED ON VOLATILE ORGANIC COMPOUNDS IN BLOOD AND URINE SAMPLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LIMITED (IL) 2022-06-30 WO claimed
US-11224241-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2022-01-18 US claimed
US-11219232-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2022-01-11 US claimed
US-10327464-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2019-06-25 US claimed
US-10314325-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2019-06-11 US claimed
EP-2943072-B2 METHODS FOR AFFECTING THE FLAVOUR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC (US) 2025-04-30 EP disclosed
US-20240298681-A1 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC. 2024-09-12 US disclosed
US-20240044832-A1 METHODS FOR DIAGNOSING CANCER BASED ON VOLATILE ORGANIC COMPOUNDS IN BLOOD AND URINE SAMPLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LIMITED (IL) 2024-02-08 US disclosed
EP-4264260-A1 METHODS FOR DIAGNOSING CANCER BASED ON VOLATILE ORGANIC COMPOUNDS IN BLOOD AND URINE SAMPLES TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) 2023-10-25 EP disclosed
EP-4104682-A2 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOUR AND AROMA PROFILE OF CONSUMABLES Impossible Foods Inc. (US) 2022-12-21 EP disclosed
WO-2022137232-A1 METHODS FOR DIAGNOSING CANCER BASED ON VOLATILE ORGANIC COMPOUNDS IN BLOOD AND URINE SAMPLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LIMITED (IL) 2022-06-30 WO disclosed
US-4713380-A Production of optically pure organoboranes ALDRICH-BORANES, INC. (US) 1987-12-15 US disclosed
EP-0248187-A2 Indole derivative MERCK PATENT GmbH (DE) 1987-12-09 EP disclosed
EP-0188235-A2 Production of optically pure organoboranes Aldrich Chemical Company, Inc. (US) 1986-07-23 EP disclosed
US-4237306-A ELECTROPHILIC REACTIONS WITH ALKYL ARYL KETONES TO PRODUCE METHYL ARYL ALKANOATES EMERY INDUSTRIES, INC. (US) 1980-12-02 US disclosed
US-4172955-A REARRANGMENT OF A CINNAMALDEHYDE TO A PHENYLMALONDIALDEHYDE TETRAMETHYL DISACETAL EMERY INDUSTRIES, INC. (US) 1979-10-30 US disclosed
US-4067823-A Thallium(III) reagents supported on montmorillonite clay minerals and oxythallation processes for utilizing same EMERY INDUSTRIES, INC. (US) 1978-01-10 US disclosed
US-3946081-A OXIDATION CATALYSTS, GROUP V, VI, OR VII OXIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed