SCHEMBL245863

SCHEMBL245863

CC(CO)(CO)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.58
HIF1A Q16665 1/20 0.58
ALDH1A1 P00352 2/20 0.46
TAAR1 Q96RJ0 1/20 0.46
ALOX15 P16050 1/20 0.46
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44
CYP3A4 P08684 1/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40

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
SCHEMBL7040834 0.88 CYP2C19 (0.52) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL10154496 0.86 TAAR1 (0.56) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL9513410 0.86 CYP2C19 (0.50) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL7041512 0.84 CYP2C19 (0.48) CYP2C19HIF1AALDH1A1TAAR1ALOX15
Acrylic Acid SCHEMBL1724043 0.84 CYP2C19 (0.53) CYP2C19HIF1AALDH1A1CYP3A4MAPT
Methacrylic Acid SCHEMBL8850862 0.84 CYP2C19 (0.53) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL15096194 0.83 CYP2C19 (0.47) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL10954181 0.81 CYP2C19 (0.50) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL5776904 0.81 ALDH1A1 (0.50) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL344966 0.80 CYP2C19 (0.54) CYP2C19HIF1AALDH1A1TAAR1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115768837-B Regenerant for asphalt regeneration 巴斯夫欧洲公司 2025-03-18 CN claimed
CN-115768837-A Regenerant for asphalt regeneration 巴斯夫欧洲公司 2023-03-07 CN claimed
CN-110863359-B Water-based transparent polishing treatment agent for clothing leather and preparation method thereof 江苏宝泽高分子材料股份有限公司 2022-05-31 CN claimed
US-20210347947-A1 HIGH-TEMPERATURE-UP-RESINS (HT-UP RESIN) BASED ON CYCLIC AND NON-CYCLIC RAW MATERIALS (HT-UP) ERFINDERGEMEINSCHAFT LORENZ GRAHNEIS GBR (DE) 2021-11-11 US claimed
EP-3197862-B1 POLYETHERAMINES BASED ON 1,3-DIALCOHOLS BASF SE (DE) 2020-06-10 EP claimed
EP-2978740-B1 POLYETHERAMINES BASED ON 1,3-DIALCOHOLS BASF SE (DE) 2020-05-13 EP claimed
US-10633328-B2 Polyetheramines based on 1,3-dialcohols BASF SE (DE) 2020-04-28 US claimed
WO-2020058460-A1 HIGH-TEMPERATURE-UP-RESINS (HT-UP RESIN) BASED ON CYCLIC AND NON-CYCLIC RAW MATERIALS (HT-UP) ERFINDERGEMEINSCHAFT LORENZ + GRAHNEIS GBR (DE) 2020-03-26 WO claimed
EP-3626759-A1 HIGH-TEMPERATURE-UP-RESINS (HT-UP RESIN) BASED ON CYCLIC AND NON-CYCLIC RAW MATERIALS (HT-UP) Erfindergemeinschaft Lorenz + Grahneis GbR (DE) 2020-03-25 EP claimed
CN-110863359-A Water-based transparent polishing treatment agent for clothing leather and preparation method thereof 江苏宝泽高分子材料股份有限公司 2020-03-06 CN claimed
WO-2014154783-A1 POLYETHERAMINES BASED ON 1,3-DIALCOHOLS BASF SE (DE) 2014-10-02 WO claimed
EP-2470156-A2 USE OF 1,3-DIOLS AS BIOCIDES BASF SE (DE) 2012-07-04 EP claimed
US-20120152149-A1 USE OF 1,3-DIOLS AS BIOCIDES BASF SE (DE) 2012-06-21 US claimed
WO-2011023582-A2 USE OF 1,3-DIOLS AS BIOCIDES BASF SE (DE) 2011-03-03 WO claimed
EP-1225172-B1 POLYORTHOESTER AND CURABLE COMPOSITION CONTAINING THE SAME KANSAI PAINT CO LTD (JP) 2004-07-21 EP claimed
EP-1225172-A1 POLYORTHOESTER AND CURABLE COMPOSITION CONTAINING THE SAME KANSAI PAINT CO., LTD. (JP) 2002-07-24 EP claimed
US-5817733-A BINDERS IN COATING COMPOSITION BASF LACKE & FARBEN, AG (DE) 1998-10-06 US claimed
EP-0740674-B1 POLYURETHANE RESINS, PROCESS FOR PRODUCING THEM AND THEIR USE IN WATER-DILUTABLE COATING AGENTS BASF COATINGS AG (DE) 1998-06-17 EP claimed
US-4929530-A OXIDATIVE LEUCO DYES, PHOTO-OXIDIZERS, REDUCING AGENTS, ORGANIC SULFONAMIDES AND PHENOLIC COMPONENTS; EXPOSING TO LIGHT FUJI PHOTO FILM CO., LTD. (JP) 1990-05-29 US claimed
US-4224429-A CROWN COMPOUNDS SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1980-09-23 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 (1 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-10633328-B2 Polyetheramines based on 1,3-dialcohols TAAR1, CHRM1, CNR2 CYP2C19 463/4885HIF1A 3212/4885ALDH1A1 1419/4885

“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.