SCHEMBL6528313

SCHEMBL6528313

CC1(c2ccccc2)CC2C=C[C@H]1C2

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.41
KDM1A O60341 6/20 0.41
MAOB P27338 11/20 0.37
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
P2RX7 Q99572 1/20 0.32
CCR2 P41597 1/20 0.32

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
SCHEMBL231895 1.00 MAOA (0.41) MAOAKDM1AMAOBCYP2D6CYP2C19
SCHEMBL1720274 0.90 NPC1 (0.37) MAOAKDM1AMAOB
SCHEMBL4243945 0.82 MAOA (0.38) MAOAKDM1AMAOBCYP2D6CYP2C19
SCHEMBL4948662 0.82 ESR2 (0.39) CYP2D6CYP2C19P2RX7
SCHEMBL1720397 0.80 SLC6A4 (0.39) KDM1A
SCHEMBL14667575 0.80 MAOB (0.44) MAOAKDM1AMAOB
SCHEMBL11740261 0.77 MAOB (0.36) MAOAKDM1AMAOB
SCHEMBL1733173 0.76 TAAR1 (0.35) KDM1ACYP2D6CYP2C19P2RX7
SCHEMBL1733751 0.76 BACE1 (0.34) CYP2D6CYP2C19P2RX7
SCHEMBL1733040 0.76 HTR2A (0.36) KDM1ACYP2D6CYP2C19P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6846890-B2 Norbornene derivative and norbornene polymer obtained therefrom through ring opening polymerization JSR CORPORATION (JP) 2005-01-25 US disclosed