SCHEMBL5214272

SCHEMBL5214272

CCNc1cnc(-c2ccccc2)c(-c2ccccc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 9/20 0.49
▸ SKP1 P63208 9/20 0.49
▸ SKP2 Q13309 9/20 0.49
▸ ADORA1 P30542 5/20 0.46
▸ ADORA2A P29274 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.44
▸ CYP1A2 P05177 3/20 0.44
▸ CASP1 P29466 3/20 0.44
▸ CASP7 P55210 3/20 0.44
▸ HSD17B10 Q99714 3/20 0.44
▸ USP2 O75604 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ CNR1 P21554 2/20 0.42
▸ HCAR3 P49019 1/20 0.39
▸ CYP2D6 P10635 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HIF1A Q16665 2/20 0.39

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
SCHEMBL30725768 0.81 CYP1A2 (0.50) CKS1BSKP1SKP2ALDH1A1CYP1A2
SCHEMBL28700972 0.81 CYP1A2 (0.50) CKS1BSKP1SKP2ALDH1A1CYP1A2
SCHEMBL5211084 0.80 CKS1B (0.53) CKS1BSKP1SKP2ADORA1ADORA2A
SCHEMBL5210572 0.79 KDM4E (0.47) CKS1BSKP1SKP2ALDH1A1CYP1A2
SCHEMBL29678770 0.76 ADORA1 (0.51) ADORA1ALDH1A1HSD17B10GAAHPGD
SCHEMBL21496597 0.76 ADORA1 (0.51) ADORA1ALDH1A1HSD17B10GAAHPGD
SCHEMBL18614739 0.76 CKS1B (0.49) CKS1BSKP1SKP2ADORA2ACNR1
SCHEMBL28686189 0.75 HIF1A (0.53) CKS1BSKP1SKP2ALDH1A1CYP1A2
SCHEMBL30725769 0.75 HIF1A (0.53) CKS1BSKP1SKP2ALDH1A1CYP1A2
SCHEMBL30605682 0.74 CKS1B (0.50) CKS1BSKP1SKP2ADORA1ADORA2A

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-7205302-B2 Anticoagulants; antilipemic agents; cardiovascular disorders NIPPON SHINYAKU CO., LTD. (JP) 2007-04-17 — — US disclosed
EP-1400518-B1 HETEROCYCLIC COMPOUND DERIVATIVES AND MEDICINES NIPPON SHINYAKU CO LTD (JP) 2007-01-17 — — EP disclosed
US-20040102436-A1 Heterocyclic compound derivatives and medicines NIPPON SHINYAKU CO., LTD. (JP) 2004-05-27 — — US disclosed
EP-1400518-A1 HETEROCYCLIC COMPOUND DERIVATIVES AND MEDICINES Nippon Shinyaku Co., Ltd. (JP) 2004-03-24 — — EP 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-20040102436-A1 Heterocyclic compound derivatives and medicines CNR2, CNR1, GPR55 CKS1B 858/4885SKP1 2426/4885SKP2 3622/4885

“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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