SCHEMBL24071853

SCHEMBL24071853

Clc1ccc2oc3c4ccccc4[nH]c3c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 7/20 0.45
▸ PIM1 P11309 2/20 0.43
▸ PIM3 Q86V86 2/20 0.43
▸ PIM2 Q9P1W9 2/20 0.43
▸ DYRK1A Q13627 2/20 0.43
▸ CCNE2 O96020 1/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ CCND1 P24385 1/20 0.43
▸ CCNE1 P24864 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ CAMK2B Q13554 1/20 0.43
▸ CAMK2G Q13555 1/20 0.43
▸ CAMK2D Q13557 1/20 0.43
▸ CAMK2A Q9UQM7 1/20 0.43
▸ CDC7 O00311 1/20 0.43
▸ DYRK3 O43781 1/20 0.43
▸ IGF1R P08069 1/20 0.43
▸ CLK2 P49760 1/20 0.43
▸ GSK3A P49840 1/20 0.43
▸ GSK3B P49841 1/20 0.43

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
SCHEMBL29499026 1.00 AHR (0.45) AHRPIM1PIM3PIM2DYRK1A
SCHEMBL28631145 0.88 AHR (0.49) AHRPIM1PIM3PIM2CCNE2
SCHEMBL24013313 0.82 AHR (0.54) AHRCCNE2CDK4CCND1CCNE1
SCHEMBL7499024 0.81 ERCC5 (0.50) DYRK1AALDH1A1KMT2ALMNATSHR
SCHEMBL16482458 0.81 KDM4E (0.46) PIM1PIM3PIM2DYRK1ACDK4
SCHEMBL17284951 0.78 AR (0.52) PIM1PIM3PIM2DYRK1ACDK2
SCHEMBL16482459 0.78 KIF11 (0.56) DYRK1ACDK2CAMK2BCAMK2GCAMK2D
SCHEMBL28506292 0.77 CA1 (0.44) AHRPIM1DYRK1ACCNE2CDK4
SCHEMBL1635623 0.77 KIF11 (0.50) AHRPIM1PIM3PIM2DYRK1A
SCHEMBL28416978 0.77 KIF11 (0.50) AHRPIM1PIM3PIM2DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021241882-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-12-02 — — WO disclosed
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