SCHEMBL16616978

SCHEMBL16616978

BrCCCCCCN1c2ccccc2Sc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.67
KDM1A O60341 11/20 0.59
SIGMAR1 Q99720 3/20 0.58
SLC22A1 O15245 1/20 0.58
PRNP P04156 1/20 0.58
TP53 P04637 1/20 0.58
CYP1A2 P05177 1/20 0.58
ADRB2 P07550 1/20 0.58
CHRM2 P08172 1/20 0.58
CHRM4 P08173 1/20 0.58
HTR1A P08908 1/20 0.58
CHRM5 P08912 1/20 0.58
ADRA2A P08913 1/20 0.58
CYP2D6 P10635 1/20 0.58
CHRM1 P11229 1/20 0.58
DRD2 P14416 1/20 0.58
TSHR P16473 1/20 0.58
ADRA2B P18089 1/20 0.58
ADRA2C P18825 1/20 0.58
CHRM3 P20309 1/20 0.58

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
SCHEMBL11402576 1.00 PIM1 (0.67) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL30950675 1.00 PIM1 (0.67) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL30950674 0.98 PIM1 (0.69) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL30950671 0.98 PIM1 (0.69) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL3770165 0.93 PIM1 (0.66) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL208025 0.91 PIM1 (0.79) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL28586304 0.88 PIM1 (0.54) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL29947142 0.85 KDM1A (0.59) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL5711001 0.85 PIM1 (0.44) PIM1KDM1ASIGMAR1SLC22A1PRNP
SCHEMBL5710987 0.85 PIM1 (0.44) PIM1KDM1ASIGMAR1SLC22A1PRNP

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109467561-B Double-donor hole transport material containing phenothiazine structure, preparation method thereof and perovskite solar cell 广东工业大学 2021-07-02 CN disclosed
US-9251964-B2 Porphyrin-based compound, dye and dye-sensitized solar cell comprising the same DAEGU GYEONGBUK INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-02-02 US disclosed
US-9251964-B2 Porphyrin-based compound, dye and dye-sensitized solar cell comprising the same DAEGU GYEONGBUK INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-02-02 US disclosed
US-9251964-B2 Porphyrin-based compound, dye and dye-sensitized solar cell comprising the same DAEGU GYEONGBUK INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-02-02 US disclosed
US-20150096618-A1 PORPHYRIN-BASED COMPOUND, DYE AND DYE-SENSITIZED SOLAR CELL COMPRISING THE SAME DAEGU GYEONGBUK INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-04-09 US disclosed
US-20150096618-A1 PORPHYRIN-BASED COMPOUND, DYE AND DYE-SENSITIZED SOLAR CELL COMPRISING THE SAME DAEGU GYEONGBUK INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-04-09 US disclosed
US-20150096618-A1 PORPHYRIN-BASED COMPOUND, DYE AND DYE-SENSITIZED SOLAR CELL COMPRISING THE SAME DAEGU GYEONGBUK INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-04-09 US disclosed