SCHEMBL16375261

SCHEMBL16375261

Cc1c(C(C)C)c2c(C(C)C)nccc2n1C(C)C

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.34
USP2 O75604 1/20 0.30
HTT P42858 1/20 0.30
NCOA1 Q15788 1/20 0.30
NCOA3 Q9Y6Q9 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
SCHEMBL16375264 0.72 RET (0.36)
SCHEMBL9968100 0.71 UTS2R (0.36) UTS2R
SCHEMBL12913619 0.69 CDK1 (0.36) USP2HTTNCOA1NCOA3
SCHEMBL16375258 0.68 RET (0.40)
SCHEMBL13977158 0.67 PTGDR (0.31)
SCHEMBL13968298 0.66 NFATC1 (0.33)
SCHEMBL12913589 0.66 ADORA2A (0.33) USP2HTTNCOA1NCOA3
SCHEMBL13438495 0.65 CCR1 (0.38)
SCHEMBL27010731 0.64 MAOA (0.33)
SCHEMBL10316409 0.64 UTS2R (0.39) UTS2RUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9458162-B2 Cyclic molecules as bruton's tyrosine kinase inhibitors NANJING ALLGEN PHARMA CO. LTD. (CN) 2016-10-04 US disclosed
US-20150011530-A1 CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITORS GUANGDONG NEWOPP BIOPHARMACEUTICALS CO., LTD. (CN) 2015-01-08 US 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-20150011530-A1 CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITORS ABL1, BTK, PRKACA UTS2R 2723/4885USP2 1897/4885HTT 4584/4885

“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.