SCHEMBL6900923

SCHEMBL6900923

Nc1[c]ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ACHE P22303 5/20 0.36
ESR1 P03372 4/20 0.36
ESR2 Q92731 4/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MAOA P21397 1/20 0.32
LMNA P02545 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.31
CYP3A4 P08684 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
SMARCA2 P51531 1/20 0.31
SMARCA4 P51532 1/20 0.31

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
SCHEMBL6899991 0.84 ALOX5 (0.47) KDM4ETDP1L3MBTL1ACHEESR1
SCHEMBL3296186 0.82 MAOA (0.48) KDM4EMAPTTDP1MAOALMNA
SCHEMBL27794059 0.74 ACHE (0.36) KDM4EMAPTTDP1MAPK1L3MBTL1
SCHEMBL3740207 0.73 ACHE (0.45) KDM4EMAPTTDP1MAPK1L3MBTL1
SCHEMBL21435730 0.73 ACHE (0.48) KDM4EMAPTTDP1MAPK1L3MBTL1
SCHEMBL12337344 0.72 MAOA (0.64) KDM4EMAPTTDP1MAPK1L3MBTL1
SCHEMBL29354925 0.72 ACHE (0.56) KDM4EMAPTTDP1MAPK1L3MBTL1
SCHEMBL36757 0.72 ACHE (0.56) KDM4EMAPTTDP1MAPK1L3MBTL1
SCHEMBL2585792 0.71 MAOA (0.56) KDM4EMAPTCA1CA2MAOA
SCHEMBL3499851 0.71 KDM4E (0.50) KDM4EMAPTTDP1MAPK1L3MBTL1

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
JP-2004315495-A NEW ARYLAMINE DERIVATIVE HAVING FLUORENE SKELETON, SYNTHETIC INTERMEDIATE OF THE SAME, METHOD FOR PRODUCING THEM AND ORGANIC EL ELEMENT TOSOH CORP 2004-11-11 JP disclosed