SCHEMBL14009000

SCHEMBL14009000

Cc1cc(CN2CCN(C)CC2)ccc1NC(=O)c1ccc(C(=O)Nc2ccc(-n3cncn3)c(F)c2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BLM P54132 1/20 0.43
▸ HPGDS O60760 1/20 0.42
▸ ABL1 P00519 3/20 0.41
▸ BCR P11274 3/20 0.41
▸ BRAF P15056 3/20 0.41
▸ EGFR P00533 3/20 0.41
▸ PDE7A Q13946 3/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ CCR5 P51681 1/20 0.40
▸ F10 P00742 1/20 0.39
▸ ALK Q9UM73 2/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ KIT P10721 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ ERBB4 Q15303 1/20 0.38
▸ MAPK14 Q16539 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
SCHEMBL14009024 0.92 BLM (0.43) BLMABL1BCRPDE7AHSP90AA1
SCHEMBL14009047 0.88 CCR5 (0.44) HPGDSABL1BCRBRAFEGFR
SCHEMBL14009029 0.86 BLM (0.46) BLMHSP90AA1ATM
SCHEMBL14008962 0.86 BLM (0.46) BLMABL1BCRHSP90AA1ATM
SCHEMBL14009078 0.86 BLM (0.47) BLMHSP90AA1ATM
SCHEMBL14009281 0.81 PDE7A (0.47) BLMPDE7AHSP90AA1ATM
SCHEMBL14008963 0.81 CYP1A2 (0.47) BLMHSP90AA1ATM
SCHEMBL14008941 0.80 KMT2A (0.47) BLMBRAFPDE7AHSP90AA1ATM
SCHEMBL14008953 0.79 PDE7A (0.46) ABL1BCRPDE7A
SCHEMBL14009052 0.76 HSP90AA1 (0.41) BLMPDE7AHSP90AA1ATM

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-7446195-B2 High affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION (US) 2008-11-04 — — US disclosed
US-7446195-B2 High affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION (US) 2008-11-04 — — US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 — — US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 — — 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-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands CDKL2, CDK2, CDKL1 BLM 2572/4885HPGDS 1337/4885ABL1 283/4885

“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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