SCHEMBL9457904

SCHEMBL9457904

N#Cc1ccc(/C=C/C2CCC(=O)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 15/20 0.59
▸ FBP1 P09467 1/20 0.44
▸ HDAC2 Q92769 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ P4HB P07237 1/20 0.39
▸ MAOA P21397 3/20 0.38
▸ NR1H3 Q13133 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
SCHEMBL9457910 1.00 MAOB (0.59) MAOBFBP1HDAC2ALDH1A1LMNA
SCHEMBL10417335 0.89 MAOB (0.49) MAOBFBP1HDAC2ALDH1A1LMNA
SCHEMBL8454093 0.83 MAOB (0.58) MAOBFBP1HDAC2ALDH1A1LMNA
SCHEMBL6011001 0.81 MAOB (0.57) MAOBFBP1HDAC2ALDH1A1LMNA
SCHEMBL8450086 0.81 MAOB (0.53) MAOBFBP1HDAC2ALDH1A1LMNA
SCHEMBL15964288 0.81 MAOB (0.64) MAOBMAOA
SCHEMBL8450091 0.81 MAOB (0.53) MAOBFBP1HDAC2ALDH1A1LMNA
SCHEMBL29260527 0.80 MAOB (0.56) MAOBFBP1HDAC2ALDH1A1LMNA
SCHEMBL29260529 0.80 MAOB (0.56) MAOBFBP1HDAC2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL14783053 0.80 MAOB (0.56) MAOBFBP1HDAC2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5238602-A Electrooptical cells HOFFMANN LA ROCHE INC. (US) 1993-08-24 — — US disclosed
US-5013478-A Electromagnetic radiation resistance; miscibility; dielectrics; rotation and guest/host cells HOFFMANN-LA ROCHE INC. (US) 1991-05-07 — — US disclosed
US-4980486-A Phenyl isothiocyanates HOFFMANN-LA ROCHE INC. (US) 1990-12-25 — — US disclosed
EP-0168683-B1 LIQUID CRYSTALS WITH ALKENYL OR ALKENYLOXY GROUPS F. HOFFMANN-LA ROCHE AG (CH) 1990-11-28 — — EP disclosed
US-4915480-A Liquid crystalline compounds and mixtures MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-04-10 — — US disclosed
EP-0167912-B1 LIQUID CRYSTAL MIXTURES CONTAINING COMPOUNDS WITH A 4-ALKENYL OR 2Z-ALKENYL LATERAL CHAIN F. HOFFMANN-LA ROCHE AG (CH) 1990-01-03 — — EP disclosed
EP-0169327-B1 PHENYLISOTHIOCYANATES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1988-01-13 — — EP disclosed
US-4709030-A 4-ALKENYL OR 2Z-ALKENYL POLYPHENYL COMPOUNDS; ELECTRO-OPTICS HOFFMANN-LA ROCHE INC. (US) 1987-11-24 — — US disclosed
EP-0122389-B1 LIQUID CRYSTAL COMPONENTS HAVING AN ALKENYL CHAIN F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1987-08-05 — — EP disclosed
US-4676604-A RADIATION RESISTANCE; MISCIBILITY; ROTATION ELECTROPTICAL CELLS HOFFMANN-LA ROCHE INC. (US) 1987-06-30 — — US disclosed
US-4621901-A ELECTROOPTICS HOFFMANN-LA ROCHE INC. (US) 1986-11-11 — — US disclosed
EP-0172360-A2 Cyclohexanecarbonitriles and their use as components for liquid crystals F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-02-26 — — EP disclosed
EP-0169327-A2 Phenylisothiocyanates F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-01-29 — — EP disclosed
EP-0168683-A2 Liquid crystals with alkenyl or alkenyloxy groups F. HOFFMANN-LA ROCHE AG (CH) 1986-01-22 — — EP disclosed
US-4565425-A Liquid crystals HOFFMANN-LA ROCHE INC. (US) 1986-01-21 — — US disclosed
EP-0167912-A2 Liquid crystal mixtures containing compounds with a 4-alkenyl or 2Z-alkenyl lateral chain F. HOFFMANN-LA ROCHE AG (CH) 1986-01-15 — — EP disclosed
EP-0122389-A2 Liquid crystal components having an alkenyl chain F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-10-24 — — EP disclosed
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