SCHEMBL12724792

SCHEMBL12724792

Cc1ccc2c(nc(C(C)(C)C)n2C)c1C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.36
▸ PDE3A Q14432 2/20 0.36
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ACSS2 Q9NR19 1/20 0.31
▸ GRM2 Q14416 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
SCHEMBL8013150 0.79 TLR8 (0.41) KDM4EMEN1ALDH1A1RAB9AKMT2A
SCHEMBL14301805 0.77 CYP1A2 (0.44) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL12724876 0.76 PIM1 (0.33) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL14958066 0.74 PDE3B (0.35) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL28566639 0.74 CLK4 (0.42) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL24188677 0.74 MEN1 (0.33) MAPTKDM4EMAPK1MEN1ALDH1A1
SCHEMBL14957158 0.73 PDE3B (0.34) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL28411172 0.68 RAB9A (0.37) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL28603619 0.68 CA2 (0.38) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL24188523 0.68 ACSS2 (0.61) MAPTKDM4EMEN1RAB9AKMT2A

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-7932257-B2 Substituted pyrazolo[4,3-d]pyrimidines as aurora kinase inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2011-04-26 — — US disclosed
US-20100179123-A1 THIENOPYRIMIDINES USEFUL AS AURORA KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2010-07-15 — — US disclosed
US-7601725-B2 Thienopyrimidines useful as Aurora kinase inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2009-10-13 — — US disclosed
US-20070027166-A1 Pyrazolo pyrimidines useful as aurora kinase inhibitors SUNESIS PHARMACEUTICALS, INC. 2007-02-01 — — 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 (2 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-20100179123-A1 THIENOPYRIMIDINES USEFUL AS AURORA KINASE INHIBITORS AURKA, AURKB, AURKC PDE3B 3749/4885PDE3A 4045/4885MAPT 1402/4885
US-20070027166-A1 Pyrazolo pyrimidines useful as aurora kinase inhibitors AURKA, AURKB, AURKC PDE3B 2878/4885PDE3A 3367/4885MAPT 1438/4885

“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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