SCHEMBL27701951

SCHEMBL27701951

NCc1ccccc1C1CC2C=CC1C2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TSHR P16473 1/20 0.35
PNMT P11086 1/20 0.34
HTR2C P28335 10/20 0.34
HTR2B P41595 9/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34
HTR2A P28223 6/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 1/20 0.33
DPP4 P27487 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
SCHEMBL22194114 0.86 KDM4E (0.38) KDM4EMEN1KMT2ATSHR
SCHEMBL30509733 0.83 KDM4E (0.40) KDM4EMEN1KMT2ATSHRSLC6A2
SCHEMBL1741736 0.83 KDM4E (0.37) KDM4EMEN1KMT2ATSHRHTR2C
SCHEMBL1266508 0.83 KDM4E (0.40) KDM4EMEN1KMT2ATSHRSLC6A2
SCHEMBL18587142 0.76 HTR2C (0.37) KDM4EMEN1KMT2ATSHRHTR2C
SCHEMBL912359 0.73 HTR2C (0.47) KDM4EMEN1KMT2ATSHRHTR2C
SCHEMBL3293431 0.73 HTR2A (0.47) KDM4EMEN1KMT2ATSHRHTR2C
SCHEMBL22194113 0.73 KDM4E (0.34) KDM4EMEN1KMT2ATSHR
SCHEMBL1741315 0.73 KDM1A (0.53) KDM4EMEN1KMT2ATSHRHTR2C
SCHEMBL29625374 0.73 HTR2A (0.47) KDM4ETSHRHTR2CHTR2BHTR2A

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
CN-101180327-A Norbornene addition copolymer and moldings ZEON CORP (JP) 2008-05-14 CN disclosed