SCHEMBL5215734

SCHEMBL5215734

Cc1ccc(-c2ncc(N(C)CCCCO)nc2-c2ccc(C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 17/20 0.50
CKS1B P61024 2/20 0.43
SKP1 P63208 2/20 0.43
SKP2 Q13309 2/20 0.43
NR1I2 O75469 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
DRD1 P21728 1/20 0.38
TBXA2R P21731 1/20 0.38
AGTR1 P30556 1/20 0.38
PTGIR P43119 1/20 0.38
PDE4D Q08499 1/20 0.38
PTGDR Q13258 1/20 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
SCHEMBL21014635 0.88 CKS1B (0.59) CNR1CKS1BSKP1SKP2NR1I2
SCHEMBL5210907 0.80 PTGIR (0.64) CNR1CKS1BSKP1SKP2NR1I2
SCHEMBL3999452 0.78 CNR1 (0.53) CNR1CKS1BSKP1SKP2NR1I2
SCHEMBL5214509 0.76 CKS1B (0.52) CNR1CKS1BSKP1SKP2NR1I2
SCHEMBL27532860 0.75 NR1I2 (0.48) CNR1CKS1BSKP1SKP2NR1I2
SCHEMBL28707155 0.73 CNR1 (0.62) CNR1CKS1BSKP1SKP2
SCHEMBL30725783 0.73 CNR1 (0.62) CNR1CKS1BSKP1SKP2
SCHEMBL5214404 0.73 CKS1B (0.56) CNR1CKS1BSKP1SKP2NR1I2
SCHEMBL5211270 0.73 CKS1B (0.56) CNR1CKS1BSKP1SKP2NR1I2
SCHEMBL5212294 0.73 CKS1B (0.56) CNR1CKS1BSKP1SKP2NR1I2

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 CNR1 2/4885CKS1B 858/4885SKP1 2426/4885

“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.