SCHEMBL24022136

SCHEMBL24022136

CCn1c2ccc(Sc3ccccc3)cc2c2cc(N(c3ccc(OC)cc3)c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3cc(N(c5ccc(OC)cc5)c5ccc6c(c5)c5cc(Sc7ccccc7)ccc5n6CC)ccc3-4)ccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK2 Q13002 4/20 0.34
MAPT P10636 4/20 0.33
KDM4E B2RXH2 4/20 0.33
PTGER4 P35408 1/20 0.33
NPSR1 Q6W5P4 3/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
AKR1B1 P15121 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
POLB P06746 2/20 0.32
GRIK1 P39086 2/20 0.31
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 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
SCHEMBL21939879 0.93 CSF1R (0.31) MAPTKDM4EALDH1A1HPGDMEN1
SCHEMBL24022102 0.93 GRIK2 (0.38) GRIK2MAPTKDM4EPTGER4NPSR1
SCHEMBL21939982 0.92 GRIK2 (0.36) GRIK2MAPTKDM4EPTGER4NPSR1
SCHEMBL21939880 0.92 HTR2C (0.32) GRIK2MAPTKDM4ENPSR1ALDH1A1
SCHEMBL21940156 0.90 PTGER4 (0.41) GRIK2MAPTKDM4EPTGER4NPSR1
SCHEMBL21940168 0.89 MAPT (0.41) GRIK2MAPTKDM4EPTGER4NPSR1
SCHEMBL21939881 0.89 PTGER4 (0.30) PTGER4
SCHEMBL21940553 0.88 GRIK2 (0.34) GRIK2MAPTKDM4EPTGER4NPSR1
SCHEMBL24022132 0.88 TSPO (0.40) GRIK2MAPTKDM4EPTGER4NPSR1
SCHEMBL24022118 0.88 GRIK2 (0.37) GRIK2MAPTKDM4EPTGER4NPSR1

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
US-11177403-B2 Perovskite solar cell KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2021-11-16 US disclosed