SCHEMBL599369

SCHEMBL599369

Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1N(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 5/20 0.47
CYP2C9 P11712 4/20 0.47
CYP1A2 P05177 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
CA2 P00918 3/20 0.47
ALDH1A1 P00352 3/20 0.47
POLB P06746 1/20 0.47
TYR P14679 1/20 0.47
CA1 P00915 2/20 0.43
PTGS2 P35354 4/20 0.43
PTGS1 P23219 3/20 0.43
LMNA P02545 4/20 0.43
TSHR P16473 2/20 0.43
GAA P10253 1/20 0.43
HSPA5 P11021 1/20 0.39
RECQL P46063 1/20 0.39
MAPT P10636 2/20 0.38
ALOX15 P16050 2/20 0.38
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38

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
SCHEMBL29393893 1.00 CYP2C19 (0.47) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL392804 0.78 SMN1; SMN2 (0.52) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL30448978 0.78 SMN1; SMN2 (0.52) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL28265349 0.78 ALDH1A1 (0.53) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL79234 0.76 SMN1; SMN2 (0.45) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL21203054 0.74 CYP2C9 (0.48) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL8167714 0.74 CYP2C9 (0.48) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL15173818 0.74 CA2 (0.59) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL7083042 0.73 CYP2C19 (0.51) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2
SCHEMBL31612404 0.73 CYP2C19 (0.51) CYP2C19CYP2C9CYP1A2SMN1; SMN2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3775017-B1 SPECIFIC COMPOUNDS AS ACCELERATORS FOR IMINE/METAL SALT-INITIATED RADICAL POLYMERIZATION OF UNSATURATED COMPOUNDS AND THE USE THEREOF AS ACCELERATORS FISCHERWERKE GMBH & CO KG (DE) 2024-11-06 EP claimed
US-20240294732-A1 COMPOSITIONS AND METHODS FOR PROTECTING ORGANIC POLYMERIC MATERIALS FROM DISCOLORATION DUE TO EXPOSURE TO UV-C LIGHT CYTEC INDUSTRIES INC. (US) 2024-09-05 US claimed
EP-4251689-A1 COMPOSITIONS AND METHODS FOR PROTECTING ORGANIC POLYMERIC MATERIALS FROM DISCOLORATION DUE TO EXPOSURE TO UV-C LIGHT Cytec Industries, Inc. (US) 2023-10-04 EP claimed
WO-2022115573-A1 COMPOSITIONS AND METHODS FOR PROTECTING ORGANIC POLYMERIC MATERIALS FROM DISCOLORATION DUE TO EXPOSURE TO UV-C LIGHT CYTEC INDUSTRIES INC. (US) 2022-06-02 WO claimed
US-20220169828-A1 COMPOSITIONS AND METHODS FOR PROTECTING ORGANIC POLYMERIC MATERIALS FROM DISCOLORATION DUE TO EXPOSURE TO UV-C LIGHT CYTEC INDUSTRIES INC. (US) 2022-06-02 US claimed
CN-112646649-A Low-temperature-resistant long-life hydraulic transmission oil composition and preparation method and application thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
US-9216411-B2 Method for inhibiting nitrosamine formation in anion exchange resins DOW GLOBAL TECHNOLOGIES LLC (US) 2015-12-22 US claimed
US-20120172463-A1 METHOD FOR INHIBITING NITROSAMINE FORMATION IN ANION EXCHANGE RESINS THE DOW CHEMICAL COMPANY 2012-07-05 US claimed
US-20120172465-A1 ANION EXCHANGE RESINS HAVING CONTROLLED NITROSAMINE FORMATION EICHER CHRIS RAYMOND (US) 2012-07-05 US claimed
EP-2471598-A1 Anion exchange resins having controlled nitrosamine formation Dow Global Technologies LLC (US) 2012-07-04 EP claimed
EP-0833851-A4 POLYURETHANE-POLYESTER HYBRID RESIN SYSTEM HAVING IMPROVED STABILITY ARISTECH CHEMICAL CORP (US) 1998-06-10 EP claimed
EP-0833851-A1 POLYURETHANE-POLYESTER HYBRID RESIN SYSTEM HAVING IMPROVED STABILITY Aristech Chemical Corporation (US) 1998-04-08 EP claimed
WO-1997040077-A1 POLYURETHANE-POLYESTER HYBRID RESIN SYSTEM HAVING IMPROVED STABILITY ARISTECH CHEMICAL CORPORATION (US) 1997-10-30 WO claimed
US-5453209-A Lubricants SIMON JUANITO A (US) 1995-09-26 US claimed
EP-0590574-A1 Chemical metal and oil treating composition and process Simon, Juanito A. (US) 1994-04-06 EP claimed
US-5169547-A Borated amino alkylphenol oil additives having corrosion, fatigue and wear resistance MOBIL OIL CORPORATION (US) 1992-12-08 US claimed
US-4859355-A CONTAINING MERCAPTANS MOBIL OIL CORPORATION (US) 1989-08-22 US claimed
US-4806130-A REACTION PRODUCT OF MANNICH BASE AND MERCAPTAN MOBIL OIL CORPORATION (US) 1989-02-21 US claimed
US-4717492-A OXIDATION RESISTANCE MOBIL OIL CORPORATION (US) 1988-01-05 US claimed
US-4514312-A LOW SULFUR, INERT TO ELASTOMERIC SEALS WITCO CHEMICAL CORPORATION (US) 1985-04-30 US claimed