SCHEMBL5634635

SCHEMBL5634635

[CH2]CC(C=O)OCCCCCCCCCCCC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.41
EPHX1 P07099 1/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 1/20 0.38
LPAR1 Q92633 4/20 0.36
LPAR3 Q9UBY5 4/20 0.36
TSHR P16473 3/20 0.35
LPAR2 Q9HBW0 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
NAAA Q02083 1/20 0.34

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
SCHEMBL10432238 0.92 TSHR (0.35) DNM1EPHX1ADH1BADH1CADH1A
SCHEMBL16061313 0.84 DNM1 (0.44) DNM1EPHX1ADH1BADH1CADH1A
SCHEMBL8941926 0.84
SCHEMBL27797457 0.82 DNM1 (0.41) DNM1EPHX1ADH1BADH1CADH1A
SCHEMBL27816517 0.81 ALDH1A1 (0.45) DNM1EPHX1LPAR1LPAR3LPAR2
SCHEMBL11293582 0.79 LPAR1 (0.49) DNM1EPHX1ADH1BADH1CADH1A
SCHEMBL11732153 0.79 DNM1 (0.40) DNM1EPHX1ADH1BADH1CADH1A
SCHEMBL11293584 0.79 LPAR1 (0.49) DNM1EPHX1ADH1BADH1CADH1A
SCHEMBL13354395 0.78 ADH1B (0.41) DNM1EPHX1ADH1BADH1CADH1A
SCHEMBL9044982 0.77 TSHR (0.36) ADH1BADH1CADH1AADH7TSHR

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109261-B2 Latent mercaptans as multi-functional additives for halogen-containing polymer compositions ROHM AND HAAS COMPANY (US) 2006-09-19 US disclosed
US-7105109-B2 Latent mercaptans as stabilizers for halogen-containing polymer compositions ROHM AND HAAS COMPANY (US) 2006-09-12 US disclosed
US-20050176862-A1 Latent mercaptans as multi-functional additives for halogen-containing polymer compositions PMC CINCINNATI, INC. 2005-08-11 US disclosed
US-6790892-B1 MERCAPTAN-CONTAINING HEAT STABILIZER COMPOSITION SUBSTANTIALLY FREE FROM OFFENSIVE ODOR ROHM AND HAAS COMPANY 2004-09-14 US disclosed
US-6777467-B2 ODORLESS HEAT STABILIZER ROHM AND HAAS COMPANY 2004-08-17 US disclosed
US-20040143044-A1 Latent mercaptans as stabilizers for halogen-containing polymer compositions PMC CINCINNATI, INC. 2004-07-22 US disclosed
US-6743840-B1 HEAT STABILIZER; ODORLESS; DEGRADATION PRODUCTS OF A BLOCKED MERCAPTAN ROHM AND HAAS COMPANY 2004-06-01 US disclosed
US-20030216493-A1 Latent mercaptans as multi-functional additives for halogen-containing polymer compositions PMC CINCINNATI, INC. 2003-11-20 US disclosed
US-6610218-B1 Substantially free of the offensive odor typical of mercaptans and which may be used as anti-oxidants, odorants, anti-microbial agents chelating agents and photostabilizers ROHM AND HAAS COMPANY 2003-08-26 US disclosed
US-6573318-B2 Highly effective heat stabilizers in halogenated polymer are prepared by the condensation of formaldehyde and para-substituted phenol and further condensation of the crude product with mercapto containing compound ROHM AND HAAS COMPANY 2003-06-03 US disclosed
US-6559214-B1 Composition comprising a halogen containing polymer and degradation products of a blocked mercaptan present as the sole heat stabilizer during processing of the composition at an elevated temperature, said products including a free PMC CINCINNATI, INC. 2003-05-06 US disclosed
US-6548707-B1 Deodorizing; heat and oxidation resistance; stabilizers ROHM AND HAAS COMPANY 2003-04-15 US disclosed
US-6537466-B1 Odor free heat stabilizers; also serve as intermediates for antioxidants, antimicrobial agents, photostabilizers, and primary heat stabilizers ROHM AND HAAS COMPANY 2003-03-25 US disclosed
US-20020068780-A1 LATENT MERCAPTANS AS MULTI-FUNCTIONAL ADDITIVES FOR HALOGEN-CONTAINING POLYMER COMPOSITIONS PMC CINCINNATI, INC. 2002-06-06 US disclosed
US-6326518-B1 HEAT STABILIZER MORTON INTERNATIONAL, INC. 2001-12-04 US disclosed