SCHEMBL16201751

SCHEMBL16201751

Cc1cccc(N(c2ccc3ccccc3c2)c2cc3c(c4ccccc24)-c2ccc(N(c4cccc(C(F)(F)F)c4)c4ccc5ccccc5c4)cc2C3(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.32
NR1I2 O75469 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTR2B P41595 1/20 0.30
CYP51A1 Q16850 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL16144195 0.95 CYP1A1 (0.30) CYP1A2
SCHEMBL16201747 0.92 TDP1 (0.34) NR1I2LMNACYP1A2CYP3A4MAPT
SCHEMBL16201749 0.88 HTT (0.31)
SCHEMBL16204321 0.88 ALK (0.30)
SCHEMBL24236169 0.85 SIGMAR1 (0.33)
SCHEMBL16201731 0.83 HTT (0.36) TDP1
SCHEMBL16201703 0.83 KDM4E (0.30)
SCHEMBL16144141 0.83 ABCG2 (0.31) CYP1A2
SCHEMBL16201761 0.82 CYP2A6 (0.32) TDP1
SCHEMBL16144137 0.81 CYP2A6 (0.31) CYP1A2TDP1

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-9590182-B2 Benzofluorene compound, material for luminescent layer using said compound and organic electroluminescent device JNC CORPORATION (JP) 2017-03-07 US disclosed
US-20140319510-A1 BENZOFLUORENE COMPOUND, MATERIAL FOR LUMINESCENT LAYER USING SAID COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE JNC CORPORATION (JP) 2014-10-30 US disclosed