SCHEMBL690293

SCHEMBL690293

CCCCCC(CC)(CC)OC(=O)c1ccc(C(=O)OC(CC)(CC)CCCCC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
TSHR P16473 4/20 0.44
CYP1A2 P05177 3/20 0.44
CYP2C19 P33261 3/20 0.44
LMNA P02545 2/20 0.44
CYP2D6 P10635 2/20 0.44
ESR1 P03372 2/20 0.44
MAPK1 P28482 1/20 0.44
NR1H2 P55055 1/20 0.44
RNASEL Q05823 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
PDE4D Q08499 1/20 0.42
STS P08842 5/20 0.39
MGLL Q99685 1/20 0.39
TP53 P04637 1/20 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
SCHEMBL690294 0.94 TP53 (0.49) ALDH1A1MAPTTSHRTP53
SCHEMBL27968723 0.92 TP53 (0.51) ALDH1A1MAPTTSHRTP53
SCHEMBL29716211 0.92 CYP2D6 (0.49) ALDH1A1TSHRCYP1A2CYP2C19LMNA
SCHEMBL2764270 0.89 THRA (0.40) NPC1MAPTRAB9ATSHRESR1
SCHEMBL17982652 0.88 NPC1 (0.46) ALDH1A1NPC1MAPTRAB9ATSHR
SCHEMBL19856519 0.87 SMN1; SMN2 (0.43) ALDH1A1NPC1RAB9ACYP1A2CYP2C19
SCHEMBL10004451 0.87 TSHR (0.46) ALDH1A1NPC1MAPTRAB9ATSHR
SCHEMBL18817713 0.85 TP53 (0.54) ALDH1A1MAPTTSHRTP53
SCHEMBL29663544 0.84 TP53 (0.47) TSHRTP53
SCHEMBL27624844 0.84 HDAC3 (0.47) ALDH1A1NPC1RAB9ALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12565469-B2 Method for ring hydrogenation of dialkyl terephthalates with low by-product formation EVONIK OXENO GMBH & CO. KG (DE) 2026-03-03 US claimed
US-11932749-B2 Plasticizer composition comprising tripentyl esters of 1,2,4-cyclohexanetricarboxylic acid EVONIK OXENO GMBH & CO. KG (DE) 2024-03-19 US claimed
EP-4148038-B1 METHOD FOR THE RING HYDROGENATION OF DIALKYL TEREPHTHALATES WITH LOW BY-PRODUCT FORMATION EVONIK OXENO GMBH & CO KG (DE) 2024-01-10 EP claimed
US-20230092962-A1 METHOD FOR RING HYDROGENATION OF DIALKYL TEREPHTHALATES WITH LOW BY-PRODUCT FORMATION EVONIK OPERATIONS GMBH (DE) 2023-03-23 US claimed
CN-115806487-A Cyclic hydrogenation of dialkyl terephthalates with low by-product formation 赢创运营有限公司 2023-03-17 CN claimed
EP-4148038-A1 METHOD FOR THE RING HYDROGENATION OF DIALKYL TEREPHTHALATES WITH LOW BY-PRODUCT FORMATION Evonik Operations GmbH (DE) 2023-03-15 EP claimed
US-20220411604-A1 Plasticizer composition comprising tripentyl esters of 1,2,4-cyclohexanetricarboxylic acid EVONIK OPERATIONS GMBH (DE) 2022-12-29 US claimed
EP-4105272-A1 SOFTENING COMPOSITION COMPRISING TRIPENTYL ESTER OF 1,2,4-CYCLOHEXANTRICARBOXYLIC ACID Evonik Operations GmbH (DE) 2022-12-21 EP claimed
CN-115477787-A Plasticizer composition comprising tripentyl ester of 1,2, 4-cyclohexanetricarboxylic acid 赢创运营有限公司 2022-12-16 CN claimed
US-20220314514-A1 MOISTURE-CURABLE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2022-10-06 US claimed
US-8822547-B2 Hydroalcoholic gel compositions for use with dispensers GOJO INDUSTRIES, INC. (US) 2014-09-02 US claimed
EP-2460560-A1 Hydroalcoholic gel compositions for use with dispensers Gojo Industries, Inc. (US) 2012-06-06 EP claimed
EP-2288416-B1 HYDROALCOHOLIC GEL COMPOSITIONS FOR USE WITH DISPENSERS GOJO IND INC (US) 2012-02-29 EP claimed
US-20110281987-A1 Polymer Compositions Comprising Terephthalates EXXONMOBIL CHEMICAL PATENTS INC. 2011-11-17 US claimed
EP-2358801-A1 POLYMER COMPOSITIONS COMPRISING TEREPHTHALATES ExxonMobil Chemical Patents Inc. (US) 2011-08-24 EP claimed
CN-102123764-A Hydroalcoholic gel compositions for use with dispensers GOJO IND INC 2011-07-13 CN claimed
US-20110144214-A1 HYDROALCOHOLIC GEL COMPOSITIONS FOR USE WITH DISPENSERS SILVER POINT FINANCE, LLC, AS COLLATERAL AGENT 2011-06-16 US claimed
EP-2288416-A2 HYDROALCOHOLIC GEL COMPOSITIONS FOR USE WITH DISPENSERS GOJO Industries, Inc. (US) 2011-03-02 EP claimed
WO-2010071717-A1 POLYMER COMPOSITIONS COMPRISING TEREPHTHALATES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-06-24 WO claimed
WO-2009058802-A2 HYDROALCOHOLIC GEL COMPOSITIONS FOR USE WITH DISPENSERS GOJO INDUSTRIES, INC. (US) 2009-05-07 WO 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-20110144214-A1 HYDROALCOHOLIC GEL COMPOSITIONS FOR USE WITH DISPENSERS ADH1A, ADH1C, ADH5 ALDH1A1 47/4885NPC1 3355/4885MAPT 1594/4885
US-12565469-B2 Method for ring hydrogenation of dialkyl terephthalates with low by-product formation DDT, GRHPR, HPD ALDH1A1 1823/4885NPC1 3326/4885MAPT 2508/4885

“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.