SCHEMBL3826953

SCHEMBL3826953

CC(C)(C)c1ccccc1OC#N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.41
ATM Q13315 1/20 0.41
ALDH1A1 P00352 6/20 0.40
TSHR P16473 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM4E B2RXH2 3/20 0.38
GAA P10253 2/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
MAPT P10636 2/20 0.37
NISCH Q9Y2I1 1/20 0.37
CA2 P00918 1/20 0.37
BCHE P06276 1/20 0.36
NPSR1 Q6W5P4 3/20 0.36
HTT P42858 2/20 0.36
NAMPT P43490 1/20 0.36

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
SCHEMBL30003749 1.00 TDP1 (0.41) TDP1ATMALDH1A1TSHRCYP1A2
SCHEMBL5586106 0.88 SGMS2 (0.36) TDP1ATMALDH1A1TSHRCYP1A2
SCHEMBL27228587 0.88 SGMS2 (0.36) TDP1ATMALDH1A1TSHRCYP1A2
SCHEMBL23674233 0.81 SGMS2 (0.33) CYP1A2CYP2D6CYP2C19HSD17B10SGMS2
SCHEMBL4531219 0.81 ALDH1A1 (0.37) TDP1ATMALDH1A1TSHRCYP2D6
SCHEMBL8975598 0.81 TDP1 (0.42) TDP1ATMALDH1A1TSHRCYP1A2
SCHEMBL6874916 0.79 TDP1 (0.41) TDP1ATMALDH1A1TSHRCYP1A2
SCHEMBL3636639 0.79 TDP1 (0.45) TDP1ATMALDH1A1TSHRCYP1A2
SCHEMBL10885202 0.79 TSHR (0.36) TSHR
SCHEMBL17914533 0.79 AR (0.40) RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116438244-B Crosslinkable organosiloxanes alkane modified reaction resins 瓦克化学股份公司 2024-08-30 CN disclosed
US-20240247107-A1 CROSS-LINKABLE ORGANOSILOXANE-MODIFIED REACTION RESINS WACKER CHEMIE AG (DE) 2024-07-25 US disclosed
EP-4153658-B1 CROSS-LINKABLE ORGANOSILOXANE-MODIFIED REACTION RESINS WACKER CHEMIE AG (DE) 2023-12-06 EP disclosed
US-20230272164-A1 CROSS-LINKABLE ORGANOSILOXANE-MODIFIED REACTION RESINS WACKER CHEMIE AG (DE) 2023-08-31 US disclosed
CN-116438244-A Crosslinkable organosiloxane modified reactive resins 瓦克化学股份公司 2023-07-14 CN disclosed
CN-115698139-A Crosslinkable organosiloxane-modified reaction resins 瓦克化学股份公司 2023-02-03 CN disclosed
CN-110506066-A Resin combination, prepreg, clad with metal foil plywood, resin sheet and printed circuit board MITSUBISHI GAS CHEMICAL CO 2019-11-26 CN disclosed
CN-109415489-A Resin combination, resin sheet, multilayer printed-wiring board and semiconductor device 三菱瓦斯化学株式会社 2019-03-01 CN disclosed
CN-109071745-A Cyanate ester compound, method for producing same, resin composition, cured product, prepreg, sealing material, fiber-reinforced composite material, adhesive, metal foil-clad laminate, resin sheet, and printed wiring board 三菱瓦斯化学株式会社 2018-12-21 CN disclosed
CN-105308084-A Cyanate ester compound, curable resin composition containing said compound, and cured product of said composition MITSUBISHI GAS CHEMICAL CO 2016-02-03 CN disclosed
EP-1951814-A1 POLY(ARYLENE ETHER) COMPOSITION, METHOD, AND ARTICLE General Electric Company (US) 2008-08-06 EP disclosed
EP-1940936-A1 POLYMER COMPOSITION, METHOD, AND ARTICLE General Electric Company (US) 2008-07-09 EP disclosed
WO-2008036454-A1 POLY (ARYLENE ETHER) COPOLYMER SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-03-27 WO disclosed
WO-2007044312-A1 POLY(ARYLENE ETHER) COMPOSITION, METHOD, AND ARTICLE GENERAL ELECTRIC COMPANY (US) 2007-04-19 WO disclosed
WO-2007044489-A1 FLAME RETARDANT COMPOSITION AND METHOD GENERAL ELECTRIC COMPANY (US) 2007-04-19 WO disclosed
WO-2007044294-A1 POLYMER COMPOSITION, METHOD, AND ARTICLE GENERAL ELECTRIC COMPANY (US) 2007-04-19 WO disclosed
US-20070082986-A1 Polymer composition, method, and article SABIC GLOBAL TECHNOLOGIES IP B.V. (NL) 2007-04-12 US disclosed
US-20070080330-A1 Flame retardant composition and method CITIBANK, N.A., AS COLLATERAL AGENT 2007-04-12 US disclosed
US-20070082987-A1 Poly(arylene ether) composition, method, and article SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2007-04-12 US disclosed
US-3994949-A REACTION OF PHENOLATE WITH CYANOGEN HALIDE, TERT-AMINE CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1976-11-30 US disclosed