SCHEMBL4100310

SCHEMBL4100310

CC1(C(=O)Oc2ccc3ccccc3c2)CC2C=CC1C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
FAAH O00519 1/20 0.40
EPHX1 P07099 1/20 0.40
P2RX7 Q99572 1/20 0.38
CHRNA3 P32297 1/20 0.38
PTPN7 P35236 1/20 0.38
CETP P11597 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 1/20 0.37
RAB9A P51151 2/20 0.37
FABP7 O15540 1/20 0.37
FABP3 P05413 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
ADAM17 P78536 1/20 0.36
CYP1A2 P05177 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
SCHEMBL201527 0.85 P2RX7 (0.41) L3MBTL1KMT2AMEN1MAPTTDP1
SCHEMBL4103952 0.84 KMT2A (0.43) KMT2AMEN1MAPTTDP1P2RX7
SCHEMBL4100519 0.79 KMT2A (0.46) L3MBTL1KMT2AMEN1MAPTTDP1
SCHEMBL5066637 0.78 GAA (0.36) MAPTP2RX7CHRNA3CETPHPGD
SCHEMBL27592004 0.73 KMT2A (0.53) L3MBTL1KMT2AMEN1MAPTTDP1
SCHEMBL14494456 0.73 L3MBTL1 (0.41) L3MBTL1KMT2AMEN1MAPTTDP1
SCHEMBL200115 0.72 P2RX7 (0.41) KMT2AMEN1MAPTTDP1P2RX7
SCHEMBL18938394 0.72 P2RX7 (0.41) KMT2AMEN1MAPTTDP1P2RX7
SCHEMBL2899258 0.72 MAPT (0.40) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL30924171 0.72 MAPT (0.65) L3MBTL1KMT2AMEN1MAPTTDP1

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
US-20090209705-A1 THERMOPLASTIC RESIN COMPOSITION, OPTICAL FILM AND RETARDATION FILM JSR CORPORATION (JP) 2009-08-20 US disclosed
EP-1795559-A1 THERMOPLASTIC RESIN COMPOSITION, OPTICAL FILM AND RETARDATION FILM JSR Corporation (JP) 2007-06-13 EP disclosed