SCHEMBL6568720

SCHEMBL6568720

Cc1ccc(C2C(c3ccccc3)=C(c3ccccc3)C(c3ccccc3)=C2c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAOB P27338 7/20 0.39
MAOA P21397 4/20 0.39
LMNA P02545 3/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
ACHE P22303 1/20 0.39
AGTR1 P30556 1/20 0.39
HPGD P15428 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
NFKB1 P19838 1/20 0.37
RAB9A P51151 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HDAC4 P56524 1/20 0.35
DPP4 P27487 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
SCHEMBL18691989 0.85 LMNA (0.41) MAOBMAOALMNATDP1KDM1A
SCHEMBL146501 0.85 LMNA (0.41) MAOBMAOALMNATDP1KDM1A
SCHEMBL15518760 0.83 LMNA (0.40) MAOBMAOALMNAKDM1A
Ethylene SCHEMBL4942079 0.81 LMNA (0.39) MAOBMAOALMNAKDM1A
SCHEMBL6570377 0.80 CYP1A2 (0.48) MEN1KMT2AMAOBMAOALMNA
SCHEMBL4943423 0.80 MMP3 (0.48) MEN1KMT2ALMNATDP1KDM1A
SCHEMBL6572088 0.80 PTGS1 (0.40) MEN1KMT2AMAOBMAOALMNA
SCHEMBL4941871 0.77 ALDH1A1 (0.37) MEN1KMT2AHPGDTDP1NPC1
SCHEMBL4942556 0.76 ALDH1A1 (0.45) MAOBLMNATSHRPOLBKDM1A
SCHEMBL27593860 0.75 HSD17B10 (0.38) MAOBMAOALMNATDP1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1404446-A2 CATALYST COMPRISING CHROMIUM AND A LIGAND COMPRISING A SUBSTITUTED CYCLOPENTADIENE AND ITS USE FOR TRIMERISING OLEFINS Sasol Technology (Proprietary) Limited (ZA) 2004-04-07 EP disclosed
WO-2003004158-A2 CATALYST COMPRISING CHROMIUM AND A LIGAND COMPRISING A SUBSTITUTED CYCLOPENTADIENE AND ITS USE FOR TRIMERISING OLEFINS SASOL TECHNOLOGY (PROPRIETARY) LIMITED (ZA) 2003-01-16 WO disclosed