SCHEMBL891499

SCHEMBL891499

CC(C)CC=C(C=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
ASF1A Q9Y294 1/20 0.39
NR1H4 Q96RI1 1/20 0.36
PGR P06401 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
HTR2A P28223 1/20 0.36
HRH1 P35367 1/20 0.36
KCNH2 Q12809 1/20 0.36
HPGD P15428 3/20 0.36
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
XBP1 P17861 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GRIK1 P39086 1/20 0.35
MTNR1A P48039 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
SCHEMBL891343 1.00 ALDH1A1 (0.41) ALDH1A1MAPK1TDP1ASF1ANR1H4
SCHEMBL2432464 1.00 ALDH1A1 (0.41) ALDH1A1MAPK1TDP1ASF1ANR1H4
SCHEMBL28788617 0.81 AKT1 (0.39) ALDH1A1ASF1APGRADRA2AADRA2B
SCHEMBL27966885 0.81 TDP1 (0.41) ALDH1A1MAPK1TDP1NR1H4HPGD
SCHEMBL28788613 0.81 AKT1 (0.39) ALDH1A1ASF1APGRADRA2AADRA2B
SCHEMBL4722353 0.81 TSHR (0.40) ALDH1A1HTR2ASMN1; SMN2LMNAMEN1
SCHEMBL4722351 0.81 TSHR (0.40) ALDH1A1HTR2ASMN1; SMN2LMNAMEN1
SCHEMBL7427758 0.79 ASF1A (0.38) ALDH1A1TDP1ASF1APGRADRA2A
SCHEMBL7427754 0.79 ASF1A (0.38) ALDH1A1TDP1ASF1APGRADRA2A
SCHEMBL2171580 0.79 ALDH1A1 (0.45) ALDH1A1MAPK1TDP1PGRADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260096574-A1 CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS VOYAGE FOODS INC (US) 2026-04-09 US claimed
EP-4680020-A1 COMPOSITIONS INCLUDING ALDEHYDES WITH IMPROVED RELEASE RATE AND DEGRADATION PROPERTIES FMC Agricultural Solutions A/S (DK) 2026-01-21 EP claimed
US-20260007144-A1 CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS VOYAGE FOODS INC (US) 2026-01-08 US claimed
US-20250280857-A1 DEGRADATION-RESISTANT ALDEHYDE-CONTAINING COMPOSITIONS ZOOMESSENCE INC (US) 2025-09-11 US claimed
EP-4444108-B1 ALDEHYDE MIXTURES FOR FLAVOUR IMPROVEMENT SYMRISE AG (DE) 2025-09-10 EP claimed
EP-4606226-A2 CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS Voyage Foods, Inc. (US) 2025-08-27 EP claimed
EP-4578292-A1 CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS Voyage Foods, Inc. (US) 2025-07-02 EP claimed
CN-119924491-A Flavoring composition with balanced taste characteristics 西姆莱斯有限公司 2025-05-06 CN claimed
WO-2025069031-A1 FERMENTATION-DERIVED FLAVOR MATERIALS PRODUCED FROM OILSEEDS AND PLANTS AND EDIBLE COMPOSITIONS CONTAINING SAME THE MEDITERRANEAN FOOD LAB LTD (IL) 2025-04-03 WO claimed
CN-119655345-A Coffee replica made from a single component 航行食品股份有限公司 2025-03-21 CN claimed
WO-2001087080-A2 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2001-11-22 WO claimed
WO-2001087095-A1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2001-11-22 WO claimed
WO-2001087096-A1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2001-11-22 WO claimed
US-5931995-A Ink compositions XEROX CORPORATION (US) 1999-08-03 US claimed
US-5919552-A Coated substrates and methods XEROX CORPORATION (US) 1999-07-06 US claimed
US-5897961-A USEFUL FOR INK JET PRINTING AND ELECTROSTATIC PRINTING XEROX CORPORATION (US) 1999-04-27 US claimed
US-5763128-A Simulated photographic-quality images on a substrate without curl XEROX CORPORATION (US) 1998-06-09 US claimed
US-4191785-A CHOCOLATE-LIKE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1980-03-04 US claimed
US-4093752-A FOODSTUFFS, CHEWING GUM, TOOTHPASTE, MEDICINES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-06-06 US claimed
US-3958029-A Novel flavoring compositions and products comprising 2,5-dimethyl-3-thioisovaleryl furan INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-05-18 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-20260007144-A1 CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS HAAO, PTGES2, PTGES ALDH1A1 74/4885MAPK1 3871/4885TDP1 2866/4885
US-20260096574-A1 CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS HAAO, HTR6, SCD ALDH1A1 492/4885MAPK1 4258/4885TDP1 4331/4885

“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.