SCHEMBL17690402

SCHEMBL17690402

Brc1ccc2c(c1)oc1nc3ccccc3cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.43
GRM4 Q14833 1/20 0.40
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
GLA P06280 2/20 0.38
HPGD P15428 2/20 0.38
ACHE P22303 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 3/20 0.37
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
PTBP1 P26599 1/20 0.37
RCE1 Q9Y256 1/20 0.37
TBK1 Q9UHD2 2/20 0.36
CYP2A6 P11509 1/20 0.36
BIRC5 O15392 1/20 0.36

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
SCHEMBL17690425 0.88 IDO1 (0.43) IDO1GRM4MAPTALDH1A1GLA
SCHEMBL10617204 0.82 IDO1 (0.49) IDO1GRM4MAPTALDH1A1GLA
SCHEMBL29287086 0.81 MEN1 (0.38) MAPTALDH1A1HPGDKMT2AKDM4E
SCHEMBL23940175 0.81 IDO1 (0.43) IDO1MAPTALDH1A1GLAHPGD
SCHEMBL17690410 0.81 IDO1 (0.43) IDO1MAPTALDH1A1GLAHPGD
SCHEMBL177371 0.80 TBK1 (0.55) IDO1MAPTALDH1A1HPGDKMT2A
SCHEMBL17756888 0.78 CA1 (0.41) IDO1MAPTALDH1A1GLAHPGD
SCHEMBL29596943 0.76 CYP2A6 (0.48) GRM4MAPTALDH1A1HPGDKMT2A
SCHEMBL10122754 0.76 CYP2A6 (0.48) GRM4MAPTALDH1A1HPGDKMT2A
SCHEMBL30277934 0.76 CYP2A6 (0.48) GRM4MAPTALDH1A1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3010055-B1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO (JP) 2021-10-20 EP disclosed
US-20160141515-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-05-19 US disclosed
US-20160141515-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-05-19 US disclosed
EP-3010055-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME, AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd (JP) 2016-04-20 EP 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-20160141515-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME, AND ELECTRONIC DEVICE OR10J3, PIEZO1, L1CAM IDO1 4070/4885GRM4 1213/4885MAPT 1447/4885

“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.