SCHEMBL18594338

SCHEMBL18594338

Clc1cc2c3ccccc3oc2c2c1[nH]c1ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 3/20 0.54
▸ MAP3K11 Q16584 2/20 0.44
▸ MAP3K9 P80192 1/20 0.44
▸ CDK5 Q00535 4/20 0.43
▸ DYRK1A Q13627 4/20 0.43
▸ CDK5R1 Q15078 3/20 0.43
▸ GSK3A P49840 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ CCNE2 O96020 2/20 0.39
▸ CDK4 P11802 2/20 0.39
▸ CCND1 P24385 2/20 0.39
▸ CCNE1 P24864 2/20 0.39
▸ CDK2 P24941 2/20 0.39
▸ CAMK2B Q13554 2/20 0.39
▸ CAMK2G Q13555 2/20 0.39
▸ CAMK2D Q13557 2/20 0.39
▸ CAMK2A Q9UQM7 2/20 0.39
▸ CLK1 P49759 1/20 0.38
▸ GABRP O00591 3/20 0.38
▸ GABRD O14764 3/20 0.38

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
SCHEMBL18593650 0.90 AHR (0.55) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL19866497 0.87 AHR (0.42) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL30007687 0.82 MAP3K11 (0.44) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL16201582 0.82 MAP3K11 (0.44) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL30019295 0.82 MAP3K11 (0.44) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL27142939 0.81 IDO1 (0.42) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL24519133 0.80 HPGD (0.45) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL30388393 0.79 CCNE2 (0.43) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL25202208 0.79 CCNE2 (0.43) AHRMAP3K11MAP3K9CDK5DYRK1A
SCHEMBL17465511 0.78 MAP3K11 (0.51) MAP3K11MAP3K9CDK5DYRK1ACDK5R1

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
US-10230056-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2019-03-12 — — US disclosed
US-20180047914-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-02-15 — — US disclosed
US-20180047914-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-02-15 — — US disclosed
WO-2017034303-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2017-03-02 — — 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 (2 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-10230056-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, NR2E3 AHR 27/4885MAP3K11 3863/4885MAP3K9 3934/4885
US-20180047914-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, NR2E3 AHR 27/4885MAP3K11 3863/4885MAP3K9 3934/4885

“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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