SCHEMBL8448368

SCHEMBL8448368

CCCc1ccc(CCC2CCC(=O)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.51
▸ MAOA P21397 1/20 0.51
▸ MGLL Q99685 1/20 0.40
▸ GPR84 Q9NQS5 1/20 0.39
▸ CA2 P00918 1/20 0.38
▸ LPL P06858 1/20 0.36
▸ LIPG Q9Y5X9 1/20 0.36
▸ PLK1 P53350 1/20 0.36
▸ DDB1 Q16531 1/20 0.35
▸ CRBN Q96SW2 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ CARM1 Q86X55 1/20 0.35
▸ PRMT6 Q96LA8 1/20 0.35

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
SCHEMBL8009498 0.81 MAOA (0.49) MAOBMAOACARM1PRMT6
SCHEMBL14862904 0.81 MAOB (0.55) MAOB
SCHEMBL2382152 0.81 CYP2C9 (0.50) MAOBMAOAGPR84
SCHEMBL11058080 0.81 MAOB (0.57) MAOBMAOAGPR84CA2LPL
SCHEMBL11058086 0.81 MAOB (0.57) MAOBMAOAGPR84CA2LPL
SCHEMBL10697228 0.79 MAOB (0.55) MAOBMAOALPLLIPG
SCHEMBL9419274 0.79 ESR2 (0.55) —
SCHEMBL9457804 0.78 MAOA (0.56) MAOBMAOAGPR84DDB1CRBN
SCHEMBL8455463 0.78 NAAA (0.38) DDB1CRBN
SCHEMBL27540930 0.78 PTGER4 (0.46) MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5858275-A Chlorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1999-01-12 — — US disclosed
CN-1158601-A Chlorobenzene derivatives and liquid crystal compositions containing the same CHISSO CORP (JP) 1997-09-03 — — CN disclosed
EP-0785179-A1 CHLOROBENZENE DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORPORATION (JP) 1997-07-23 — — EP disclosed
EP-0362318-B1 2,3-DIFLUOROBIPHENYLS MERCK PATENT GmbH (DE) 1993-08-04 — — EP disclosed
US-5204019-A Liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-04-20 — — US disclosed
EP-0362318-A1 2,3-DIFLUOROBIPHENYLS. MERCK PATENT GMBH (DE) 1990-04-11 — — EP disclosed
WO-1989008687-A1 2,3-DIFLUOROBIPHENYLS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 — — WO disclosed
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