SCHEMBL16851890

SCHEMBL16851890

c1ccc(-c2ccc(N(c3ccc4sc5ccccc5c4c3)c3cc4c5ccccc5n5c6ccccc6c(c3)c45)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.34
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN12 Q05209 1/20 0.33
PTPN22 Q9Y2R2 1/20 0.33
CYP1A2 P05177 1/20 0.32
TSPO P30536 1/20 0.31
HPGD P15428 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PIM3 Q86V86 1/20 0.30
APP P05067 1/20 0.30
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 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
SCHEMBL16852065 1.00 GPR3 (0.34) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16852059 0.96 GPR3 (0.33) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16851892 0.94 ALDH1A1 (0.35) GPR3TSPOHPGDRAB9ASMN1; SMN2
SCHEMBL17612066 0.93 TSPO (0.34) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16850721 0.93 TSPO (0.34) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16852060 0.93 TSPO (0.36) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16852062 0.93 TSPO (0.36) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16842814 0.92 GPR3 (0.32) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16842834 0.92 GPR3 (0.32) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL16851896 0.92 GPR3 (0.32) GPR3HPGDRAB9ASMN1; SMN2ALDH1A1

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-20150179956-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-25 US disclosed
US-20150179956-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150179956-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME L1CAM, ELAVL1, OR10J3 GPR3 4672/4885PTPN7 3963/4885DUSP3 4533/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.