SCHEMBL3965544

SCHEMBL3965544

S=C=Nc1ccc(C2CCCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY6 Q15077 1/20 0.44
▸ MIF P14174 1/20 0.43
▸ NOS3 P29474 2/20 0.43
▸ NOS1 P29475 2/20 0.43
▸ NOS2 P35228 2/20 0.43
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ GAA P10253 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ HAO1 Q9UJM8 2/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SLC18A3 Q16572 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ HSP90AA1 P07900 1/20 0.37

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
SCHEMBL18553011 0.95 NOTUM (0.41) P2RY6MIFNOS3NOS1NOS2
SCHEMBL13463412 0.90 P2RY6 (0.39) P2RY6MIFNOS3NOS1NOS2
SCHEMBL12011015 0.81 ESR2 (0.52) P2RY6MIFNOS3NOS1NOS2
SCHEMBL2769234 0.81 CYP3A4 (0.44) NOS3NOS1NOS2LMNAHTT
SCHEMBL25919020 0.80 S1PR1 (0.38) P2RY6MIFNOS3NOS1NOS2
SCHEMBL4055904 0.78 CYP3A4 (0.45) NOS3NOS1NOS2LMNAHTT
SCHEMBL24293852 0.78 P2RY6 (0.38) P2RY6MIFCA1CA2RAB9A
SCHEMBL12011016 0.78 ESR2 (0.47) P2RY6MIFNOS3NOS1NOS2
SCHEMBL18553005 0.78 ESR2 (0.47) P2RY6MIFNOS3NOS1NOS2
SCHEMBL10611140 0.78 P2RY6 (0.42) P2RY6MIFNOS3NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541137-B2 Resist resolution using anisotropic acid diffusion SUZHOU TECHNOLOGY INSTITUTE FOR NANOTECH INDUSTRY (CN) 2009-06-02 — — US claimed
WO-2007076361-A2 IMPROVING RESIST RESOLUTION USING ANISOTROPIC ACID DIFFUSION ADVANCED TECHNOLOGY DEVELOPMENT FACILITY, INC. (US) 2007-07-05 — — WO claimed
US-20070141517-A1 Resist resolution using anisotropic acid diffusion ADVANCED TECHNOLOGY DEVELOPMENT FACILITY, INC. 2007-06-21 — — US claimed
US-10023798-B2 Liquid crystal compositions comprising mesogenic compounds, and devices for high-frequency thechnology SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-07-17 — — US disclosed
US-20170051202-A1 LIQUID CRYSTAL COMPOSITIONS COMPRISING MESOGENIC COMPOUNDS, AND DEVICES FOR HIGH-FREQUENCY THECHNOLOGY SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-02-23 — — US disclosed
WO-2012120505-A1 VARIABLE LASER BEAM SHAPING ASSEMBLY ORBOTECH LTD. (IL) 2012-09-13 — — WO disclosed
US-7541137-B2 Resist resolution using anisotropic acid diffusion SUZHOU TECHNOLOGY INSTITUTE FOR NANOTECH INDUSTRY (CN) 2009-06-02 — — US disclosed
WO-2007076361-A2 IMPROVING RESIST RESOLUTION USING ANISOTROPIC ACID DIFFUSION ADVANCED TECHNOLOGY DEVELOPMENT FACILITY, INC. (US) 2007-07-05 — — WO disclosed
US-20070141517-A1 Resist resolution using anisotropic acid diffusion ADVANCED TECHNOLOGY DEVELOPMENT FACILITY, INC. 2007-06-21 — — US disclosed
EP-0021806-B1 2,3-DIHYDRO-IMIDAZO (2,1-B) BENZOTHIAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM JANSSEN PHARMACEUTICA N.V. (BE) 1983-01-12 — — EP disclosed
US-4364942-A ANTIDEPRESSANTS, INHIBITORS OF MONOAMINE OXIDASE JANSSEN PHARMACEUTICA N.V. (BE) 1982-12-21 — — US disclosed
US-4340738-A ENZYME INHIBITORS, ANTIDEPRESSANTS JANSSEN PHARMACEUTICA, N.V. (BE) 1982-07-20 — — US disclosed
US-4262004-A MONOAMINE OXIDASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 1981-04-14 — — US disclosed
EP-0021806-A1 2,3-Dihydro-imidazo (2,1-b) benzothiazole derivatives and pharmaceutical compositions containing them JANSSEN PHARMACEUTICA N.V. (BE) 1981-01-07 — — EP disclosed
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