SCHEMBL20712297

SCHEMBL20712297

Brc1ccc2c(c1)[nH]c1oc3ccccc3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK5 Q00535 5/20 0.46
▸ CCNB2 O95067 4/20 0.46
▸ CDK1 P06493 4/20 0.46
▸ CCNB1 P14635 4/20 0.46
▸ CCNB3 Q8WWL7 4/20 0.46
▸ CDK5R1 Q15078 4/20 0.46
▸ CDK4 P11802 3/20 0.46
▸ CCND1 P24385 3/20 0.46
▸ CAMK2B Q13554 2/20 0.46
▸ CAMK2G Q13555 2/20 0.46
▸ CAMK2D Q13557 2/20 0.46
▸ CAMK2A Q9UQM7 2/20 0.46
▸ CCNE2 O96020 2/20 0.46
▸ CCNE1 P24864 2/20 0.46
▸ CDK2 P24941 2/20 0.46
▸ CCNT1 O60563 1/20 0.46
▸ EIF2AK2 P19525 1/20 0.46
▸ CCNA2 P20248 1/20 0.46
▸ CDK9 P50750 1/20 0.46
▸ TNKS O95271 1/20 0.41

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
SCHEMBL16276665 0.88 CCNB2 (0.46) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL31606608 0.81 ALDH1A1 (0.44) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL15024931 0.81 ALDH1A1 (0.44) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL20705970 0.81 AHR (0.42) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL14992666 0.78 JAK2 (0.44) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL18647105 0.74 CYP1A2 (0.47) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL12105396 0.72 AR (0.52) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL20712203 0.71 CCNB2 (0.59) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL28648000 0.71 GABRP (0.47) CDK5CCNB2CDK1CCNB1CCNB3
SCHEMBL10614221 0.71 MAOA (0.54) CDK5CDK5R1GSK3BGSK3AMEN1

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-2019027163-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE USING SAME 덕산네오룩스 주식회사 2019-02-07 — — WO disclosed
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