SCHEMBL9007777

SCHEMBL9007777

CCCCCCCCCCCCCCCCC(CC)c1nc(-c2nc(N)nc(N)n2)c[nH]1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 2/20 0.33
▸ CCNB1 P14635 2/20 0.33
▸ NR1I2 O75469 1/20 0.32
▸ CCNA2 P20248 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ CCNA1 P78396 1/20 0.31
▸ DHFR P00374 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.30
▸ PDPK1 O15530 1/20 0.30

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
SCHEMBL8160381 0.99 CDK1 (0.32) CDK1CCNB1NR1I2CCNA2CDK2
SCHEMBL8154022 0.95 CDK1 (0.30) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL8158896 0.89 — —
SCHEMBL8158698 0.86 KDM4E (0.33) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL1198712 0.76 CDK1 (0.32) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL4814520 0.70 TLR8 (0.40) DHFRGPR84
SCHEMBL1691872 0.69 GPR84 (0.40) NR1I2GPR84
SCHEMBL4817608 0.68 TLR8 (0.42) —
SCHEMBL4817122 0.68 TLR8 (0.39) DHFRGPR84
SCHEMBL31296113 0.65 CYP1A2 (0.40) NR1I2GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0340928-B1 Positively chargeable toner SHIKOKU CHEM (JP) 1994-06-15 — — EP claimed
US-4983485-A 2-ALKYLIMIDAZOLE DERIVATIVE; ELECTROGRAPHY SHIKOKU CHEMICALS CORPORATION (JP) 1991-01-08 — — US claimed
EP-0431930-B1 Developer for electrophotography SHARP KK (JP) 1996-10-23 — — EP disclosed
US-5266433-A Imidazole additive SHARP KABUSHIKI KAISHA (JP) 1993-11-30 — — US disclosed
EP-0431930-A2 Developer for electrophotography SHARP KABUSHIKI KAISHA (JP) 1991-06-12 — — EP disclosed
US-4983485-A 2-ALKYLIMIDAZOLE DERIVATIVE; ELECTROGRAPHY SHIKOKU CHEMICALS CORPORATION (JP) 1991-01-08 — — US disclosed
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