SCHEMBL229572

SCHEMBL229572

CCCCCC(=O)OCCCC(CC)CCCC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.70
TSHR P16473 1/20 0.70
ATM Q13315 1/20 0.70
TDP1 Q9NUW8 1/20 0.70
DGKA P23743 1/20 0.61
CA2 P00918 2/20 0.51
LMNA P02545 2/20 0.51
DNM1 Q05193 1/20 0.51
ALDH1A1 P00352 1/20 0.51
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
MAPT P10636 1/20 0.49
PAM P19021 2/20 0.47
NAAA Q02083 1/20 0.47
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HTR2C P28335 1/20 0.46

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
SCHEMBL20960099 0.93 DGKA (0.62) CYP3A4TSHRATMTDP1DGKA
SCHEMBL6243663 0.93 DGKA (0.67) CYP3A4TSHRATMTDP1DGKA
SCHEMBL19553630 0.92 DGKA (0.65) CYP3A4TSHRATMTDP1DGKA
SCHEMBL20774562 0.92 TSHR (0.68) CYP3A4TSHRATMTDP1DGKA
SCHEMBL20960163 0.92 DGKA (0.65) CYP3A4TSHRATMTDP1DGKA
SCHEMBL18204387 0.92 DGKA (0.65) CYP3A4TSHRATMTDP1DGKA
SCHEMBL20960121 0.90 DGKA (0.58) CYP3A4TSHRATMTDP1DGKA
SCHEMBL20960165 0.90 DGKA (0.58) CYP3A4TSHRATMTDP1DGKA
SCHEMBL20960175 0.90 DGKA (0.61) CYP3A4TSHRATMTDP1DGKA
SCHEMBL2230975 0.90 TSHR (0.60) CYP3A4TSHRATMTDP1DGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119731287-A Heat transfer fluid 米德尔米沃特流体有限公司 2025-03-28 CN claimed
EP-2063853-B1 USE OF C10-C14-ALKANEDIOLS IN THE PREPARATION OF A COMPOSITION FOR THE PROPHYLAXIS AND/OR TREATMENT OF MALASSEZIA-INDUCED DANDRUFF FORMATION AND COMPOSITIONS COMPRISING C10-C14-ALKANEDIOLS SYMRISE AG (DE) 2018-02-21 EP disclosed
US-9511306-B2 Dividing wall distillation columns for production of high-purity 2-ethylhexanol and fractionation method using same LG CHEM, LTD. (KR) 2016-12-06 US disclosed
US-9493722-B2 Marine lubricant TOTAL RAFFINAGE MARKETING (FR) 2016-11-15 US disclosed
EP-2291411-B1 FAST SETTING SHEET FED OFFSET INKS WITH NON AQUEOUS DISPERSION POLYMERS SUN CHEMICAL CORP (US) 2016-09-28 EP disclosed
US-8764946-B2 Dividing wall distillation columns for production of high-purity 2-ethylhexanol and fractionation method using same LG CHEM, LTD. (KR) 2014-07-01 US disclosed
US-20130334029-A1 DIVIDING WALL DISTILLATION COLUMNS FOR PRODUCTION OF HIGH-PURITY 2-ETHYLHEXANOL AND FRACTIONATION METHOD USING SAME LG CHEM, LTD. (KR) 2013-12-19 US disclosed
EP-2409746-A2 DIVIDING WALL DISTILLATION COLUMNS FOR PRODUCTION OF HIGH-PURITY 2-ETHYLHEXANOL AND FRACTIONATION METHOD USING SAME LG Chem, Ltd. (KR) 2012-01-25 EP disclosed
US-20120004473-A1 DIVIDING WALL DISTILLATION COLUMNS FOR PRODUCTION OF HIGH-PURITY 2-ETHYLHEXANOL AND FRACTIONATION METHOD USING SAME LG CHEM, LTD. (KR) 2012-01-05 US disclosed
US-20110077177-A1 MARINE LUBRICANT TOTAL RAFFINAGE MARKETING (FR) 2011-03-31 US disclosed
WO-2008046796-A2 USE OF C10-C14-ALKANE-1,2-DIOLS IN THE PREPARATION OF A COMPOSITION FOR THE PROPHYLAXIS AND/OR TREATMENT OF DERMATOPHYTE INFECTIONS SYMRISE GMBH & CO. KG (DE) 2008-04-24 WO disclosed
WO-2008046795-A1 USE OF C10-C14-ALKANEDIOLS IN THE PREPARATION OF A COMPOSITION FOR THE PROPHYLAXIS AND/OR TREATMENT OF MALASSEZIA-INDUCED DANDRUFF FORMATION AND COMPOSITIONS COMPRISING C10-C14-ALKANEDIOLS SYMRISE GMBH & CO. KG (DE) 2008-04-24 WO disclosed
EP-0639047-B1 HERBICIDAL COMPOSITIONS KVK AGRO AS (DK) 1999-10-06 EP disclosed
EP-0550779-B1 Cosmetic and dermatologic composition containing diol diesters NESTLE SA (CH) 1995-10-18 EP disclosed
EP-0639047-A1 HERBICIDAL COMPOSITIONS KVK AGRO A/S (DK) 1995-02-22 EP disclosed
EP-0637910-A1 STABILIZED HERBICIDE COMPOSITIONS. KVK AGRO AS (DK) 1995-02-15 EP disclosed
EP-0441992-B1 Process for preparing salolein and cosmetic compositious therewith NESTLE SA (CH) 1995-01-18 EP disclosed
EP-0550779-A1 Cosmetic and dermatologic composition containing diol diesters SOCIETE DES PRODUITS NESTLE S.A. (CH) 1993-07-14 EP disclosed
WO-1992009197-A1 STABILIZED HERBICIDE COMPOSITIONS KVK AGRO A/S (DK) 1992-06-11 WO disclosed
WO-1992009195-A1 HERBICIDAL COMPOSITIONS KVK AGRO A/S (DK) 1992-06-11 WO disclosed