SCHEMBL21939989

SCHEMBL21939989

CCn1c2cc(Sc3ccccc3)ccc2c2ccc(N(c3ccc(OC)cc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(N(c5ccc(OC)cc5)c5ccc6c7ccc(Sc8ccccc8)cc7n(CC)c6c5)ccc3-4)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.34
METAP2 P50579 2/20 0.33
KDM4E B2RXH2 3/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
CSF1R P07333 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
GRIK2 Q13002 3/20 0.32
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32
DYRK1A Q13627 1/20 0.32
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL24022101 0.97 HTR2C (0.35) HTR2CMETAP2KDM4EMAPTSMN1; SMN2
SCHEMBL21939986 0.92 CSF1R (0.35) METAP2CSF1RCNR1CNR2MAOA
SCHEMBL21939880 0.92 HTR2C (0.32) HTR2CMETAP2KDM4EMAPTSMN1; SMN2
SCHEMBL21939982 0.91 GRIK2 (0.36) HTR2CKDM4EMAPTSMN1; SMN2NPSR1
SCHEMBL21939887 0.90 HTR2C (0.31) HTR2CMETAP2KDM4EMAPTSMN1; SMN2
SCHEMBL24022103 0.89 CSF1R (0.37) METAP2KDM4EMAPTCSF1RALDH1A1
SCHEMBL21939622 0.88 GRIK2 (0.41) KDM4EMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL21939869 0.88 DYRK1A (0.39) METAP2KDM4EMAPTSMN1; SMN2NPSR1
SCHEMBL24022102 0.88 GRIK2 (0.38) HTR2CKDM4EMAPTSMN1; SMN2NPSR1
SCHEMBL21939877 0.87 METAP2 (0.37) METAP2KDM4EMAPTSMN1; SMN2NPSR1

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