SCHEMBL21940554

SCHEMBL21940554

CCn1c2ccc(Sc3ccccc3)cc2c2cc(N(c3ccccc3)c3ccc4c(c3)C3(c5ccccc5Sc5ccccc53)c3cc(N(c5ccccc5)c5ccc6c(c5)c5cc(Sc7ccccc7)ccc5n6CC)ccc3-4)ccc21

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
HBB P68871 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL21940553 0.93 GRIK2 (0.34) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL24022100 0.92 KDM4E (0.35) CSF1RKDM4EMEN1ALDH1A1MAPT
SCHEMBL21939983 0.91 MAPT (0.33) CSF1RKDM4EMEN1ALDH1A1MAPT
SCHEMBL21984811 0.89 MAPT (0.41) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL21940552 0.87 ACHE (0.33) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL21939879 0.87 CSF1R (0.31) CSF1RKDM4EMEN1ALDH1A1MAPT
SCHEMBL21939883 0.86 CSF1R (0.31) CSF1RKDM4EMEN1ALDH1A1MAPT
SCHEMBL24022102 0.85 GRIK2 (0.38) CSF1RKDM4EMEN1ALDH1A1MAPT
SCHEMBL21939982 0.84 GRIK2 (0.36) CSF1RKDM4EMEN1ALDH1A1MAPT
SCHEMBL21940162 0.84 GRIK2 (0.32) KDM4EMEN1ALDH1A1MAPTHPGD

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-11177403-B2 Perovskite solar cell KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2021-11-16 US disclosed
US-20200119206-A1 PEROVSKITE SOLAR CELL KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2020-04-16 US disclosed