SCHEMBL19786693

SCHEMBL19786693

Clc1cc(-c2ccncc2)cc(-c2cccnc2)n1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 6/20 0.65
▸ NQO2 P16083 1/20 0.47
▸ ADORA2A P29274 1/20 0.47
▸ ADORA2B P29275 1/20 0.47
▸ AXL P30530 1/20 0.45
▸ PBRM1 Q86U86 1/20 0.45
▸ MKNK1 Q9BUB5 1/20 0.45
▸ MKNK2 Q9HBH9 1/20 0.45
▸ CYP2A6 P11509 5/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ PIM1 P11309 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MAPT P10636 1/20 0.42

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
SCHEMBL13868442 0.81 CYP2A6 (0.62) CYP19A1AXLMKNK1MKNK2CYP2A6
SCHEMBL20426098 0.79 CYP19A1 (1.00) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL21058625 0.78 CYP19A1 (0.56) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL20427791 0.78 CYP19A1 (0.96) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL17343388 0.77 CYP19A1 (0.75) CYP19A1NQO2ADORA2AADORA2BMKNK1
SCHEMBL24589928 0.77 CYP19A1 (0.59) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL12068188 0.77 CYP2A6 (0.68) CYP19A1AXLMKNK1MKNK2CYP2A6
SCHEMBL12070033 0.77 CYP2A6 (0.68) CYP19A1AXLMKNK1MKNK2CYP2A6
SCHEMBL4719469 0.76 MAPT (0.55) NPC1RAB9AMAPT
SCHEMBL14489451 0.76 CYP19A1 (0.93) CYP19A1MKNK1MKNK2CYP2A6ALDH1A1

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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-10-03 — — US disclosed
WO-2018012781-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2018-01-18 — — WO 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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF ORC3, OR51E2, ORAI2 CYP19A1 1036/4885NQO2 4150/4885ADORA2A 4280/4885

“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.

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