SCHEMBL3269697

SCHEMBL3269697

CCN1c2[c]cccc2Oc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 6/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
TNNI3 P19429 1/20 0.38
TNNT2 P45379 1/20 0.38
TNNC1 P63316 1/20 0.38
P2RX1 P51575 1/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
SLC1A1 P43005 1/20 0.37
HTT P42858 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
PIM1 P11309 2/20 0.36
NPSR1 Q6W5P4 2/20 0.34

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
SCHEMBL762288 0.80 P2RX4 (0.49) P2RX4MEN1KMT2AMAPK1TDP1
SCHEMBL30764130 0.80 P2RX4 (0.49) P2RX4MEN1KMT2AMAPK1TDP1
SCHEMBL3269797 0.78 KDM4E (0.40) P2RX4P2RX1ALDH1A1MAPTSIGMAR1
SCHEMBL10336956 0.74 SLC1A3 (0.39) P2RX4MEN1KMT2AMAPK1TDP1
SCHEMBL10069652 0.74 P2RX4 (0.40) P2RX4MEN1KMT2AMAPK1TDP1
SCHEMBL3268784 0.72 P2RX4 (0.37) P2RX4MEN1KMT2AP2RX1ALDH1A1
SCHEMBL29759083 0.70 SIGMAR1 (0.50) P2RX4MEN1KMT2AMAPK1TDP1
SCHEMBL7696530 0.70 SIGMAR1 (0.50) P2RX4MEN1KMT2AMAPK1TDP1
SCHEMBL23544470 0.69 SLC1A3 (0.40) P2RX4MEN1KMT2AMAPK1TDP1
SCHEMBL8401275 0.69 HDAC3 (0.53) P2RX4MEN1KMT2AMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2115533-B1 PHOTOCHROMIC H-ANNELLATED BENZO(F)CHROMENES RODENSTOCK GMBH (DE) 2010-06-30 EP claimed
EP-2115533-A1 PHOTOCHROMIC H-ANNELLATED BENZOÝF¨CHROMENES Rodenstock GmbH (DE) 2009-11-11 EP claimed
WO-2008077634-A1 PHOTOCHROMIC H-ANNELLATED BENZO[F]CHROMENES RODENSTOCK GMBH (DE) 2008-07-03 WO claimed
EP-2115533-B1 PHOTOCHROMIC H-ANNELLATED BENZO(F)CHROMENES RODENSTOCK GMBH (DE) 2010-06-30 EP disclosed
EP-2115533-A1 PHOTOCHROMIC H-ANNELLATED BENZOÝF¨CHROMENES Rodenstock GmbH (DE) 2009-11-11 EP disclosed
WO-2008077634-A1 PHOTOCHROMIC H-ANNELLATED BENZO[F]CHROMENES RODENSTOCK GMBH (DE) 2008-07-03 WO disclosed