SCHEMBL27335705

SCHEMBL27335705

Cc1ccccc1-c1nc(C2=CC(C(c3ccccc3)(c3ccccc3)c3ccccc3)=CCC2C)cc(-c2cccc(C(c3ccccc3)(c3ccccc3)c3ccccc3)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.36
VCP P55072 1/20 0.34
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
KDM1A O60341 1/20 0.30
PTPN1 P18031 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
SCHEMBL21391604 0.84 NR1H4 (0.44) NR1H4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL23894207 0.78 ENPP3 (0.30)
SCHEMBL21391744 0.75 NR1H4 (0.42) NR1H4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL21387955 0.74 NR1H4 (0.33) NR1H4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL21391652 0.74 ENPP3 (0.40) NR1H4ALDH1A1TSHR
SCHEMBL21391673 0.73 MEN1 (0.44) ALDH1A1TSHRKDM1A
SCHEMBL24253147 0.70 MEN1 (0.38) NR1H4VCPALDH1A1CYP1A2PTPN1
SCHEMBL25629741 0.70 MEN1 (0.38) NR1H4VCPALDH1A1CYP1A2PTPN1
SCHEMBL26344133 0.70 AGTR1 (0.34) ALDH1A1KDM1A
SCHEMBL25630312 0.70 MAPT (0.37) NR1H4VCPALDH1A1CYP1A2CYP3A4

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
EP-4395521-A1 CONDENSED CYCLIC COMPOUND, LIGHT-EMITTING DEVICE COMPRISING THE CONDENSED CYCLIC COMPOUND, AND ELECTRONIC APPARATUS COMPRISING THE LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2024-07-03 EP disclosed