SCHEMBL16375264

SCHEMBL16375264

Cc1c(C(C)C)c2c(C(C)C)ncnc2n1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.36
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
DAPK1 P53355 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
SCHEMBL16202368 0.82 RET (0.49) RETADORA3ADORA2AADORA2BADORA1
SCHEMBL16375261 0.72 UTS2R (0.34)
SCHEMBL12913615 0.68 DAPK1 (0.51) ADORA3ADORA2AADORA2BADORA1DAPK1
SCHEMBL16375259 0.67 SRC (0.44) RET
SCHEMBL15187503 0.66
SCHEMBL24458309 0.66 ADORA2A (0.53) RETADORA3ADORA2AADORA2BADORA1
SCHEMBL22037128 0.66 MEN1 (0.41) RETADORA3ADORA2AADORA2BADORA1
SCHEMBL25388077 0.66 RET (0.49) RETADORA3ADORA2AADORA2BADORA1
SCHEMBL22102953 0.64 KDM5B (0.30)
SCHEMBL12913585 0.63 ADORA2A (0.50) ADORA3ADORA2AADORA2BADORA1DAPK1

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 RET 354/4885ADORA3 4282/4885ADORA2A 4012/4885

“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.