SCHEMBL2570458

SCHEMBL2570458

CC(C)(C)c1nc(-c2cncc(C(=O)O)c2)cn1CC1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.39
BRD4 O60885 2/20 0.37
CYP11B2 P19099 1/20 0.37
BAZ2A Q9UIF9 1/20 0.36
BRAF P15056 1/20 0.36
PDE10A Q9Y233 1/20 0.35
CNR1 P21554 2/20 0.35

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
SCHEMBL2564320 0.88 CNR2 (0.39) CNR2BRD4CYP11B2BAZ2ABRAF
SCHEMBL2571322 0.87 CNR2 (0.41) CNR2BRD4PDE10ACNR1
SCHEMBL12393459 0.86 CNR2 (0.37) CNR2BRD4BAZ2ABRAFCNR1
SCHEMBL2573492 0.86 CYP11B2 (0.42) CNR2BRD4CYP11B2BAZ2ABRAF
SCHEMBL2571829 0.83 CNR2 (0.39) CNR2BRD4BAZ2APDE10ACNR1
SCHEMBL2572048 0.81 NR5A2 (0.42) CNR2PDE10ACNR1
SCHEMBL2570363 0.81 CNR2 (0.39) CNR2BRD4BAZ2APDE10ACNR1
Hydrochloric Acid SCHEMBL2566184 0.80 CNR2 (0.42) CNR2BRD4PDE10ACNR1
SCHEMBL2571598 0.80 RIPK3 (0.45) CNR2PDE10A
SCHEMBL2571955 0.80 KDM2B (0.50) CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289502-A1 IMIDAZOLE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-11-15 US disclosed
US-8273738-B2 Imidazole derivatives KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-09-25 US disclosed
EP-2090570-B1 IMIDAZOLE DERIVATIVE KYOWA HAKKO KIRIN CO LTD (JP) 2011-11-09 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-20120289502-A1 IMIDAZOLE DERIVATIVES CNR1, CNR2, ARRB1 CNR2 2/4885BRD4 72/4885CYP11B2 312/4885

“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.