SCHEMBL10027287

SCHEMBL10027287

CCCCc1cnc2c(O)c(-c3cccnc3)ccn2c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.42
▸ CYP2C9 P11712 4/20 0.42
▸ CYP2C19 P33261 4/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CYP2D6 P10635 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ PPARA Q07869 1/20 0.37
▸ CNR1 P21554 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ GRM2 Q14416 2/20 0.36
▸ APLNR P35414 2/20 0.36
▸ CYP2E1 P05181 1/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ CYP2B6 P20813 1/20 0.36
▸ MKNK1 Q9BUB5 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36

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
SCHEMBL17808723 0.93 CYP3A4 (0.38) CYP3A4CYP2C9CYP2C19CYP1A2POLB
SCHEMBL10027285 0.83 GCGR (0.37) CYP2C9CYP2C19CYP1A2ADORA3ADORA2A
SCHEMBL10027290 0.82 SMARCA2 (0.46) KDM4EADORA3ADORA2ACNR1CNR2
SCHEMBL17808764 0.81 PDE3B (0.36) KDM4EELANECTSG
SCHEMBL10027286 0.81 DCTPP1 (0.42) ADORA3ADORA2AAPLNRELANECTSG
SCHEMBL10027235 0.79 MAPT (0.36) CYP3A4CYP1A2KDM4EELANECTSG
SCHEMBL14161894 0.79 KDR (0.50) CYP3A4CYP2C9CYP2C19CYP1A2POLB
SCHEMBL17808724 0.78 CYP2C9 (0.39) CYP3A4CYP2C9CYP2C19CYP1A2POLB
SCHEMBL10027234 0.76 MAPT (0.43) KDM4EPPARAELANECTSGMAPT
SCHEMBL17808792 0.76 CHEK1 (0.49) CYP2C19KDM4EELANECTSGMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163760-B2 Use of pyridopyrimidine compounds in the treatment of gliomas PRANA BIOTECHNOLOGY LIMITED (AU) 2012-04-24 — — US disclosed
US-8163760-B2 Use of pyridopyrimidine compounds in the treatment of gliomas PRANA BIOTECHNOLOGY LIMITED (AU) 2012-04-24 — — US disclosed
US-20100069393-A1 METHOD OF TREATMENT AND AGENTS USEFUL FOR SAME PRANA BIOTECHNOLOGY LIMITED (AU) 2010-03-18 — — US disclosed
US-20100069393-A1 METHOD OF TREATMENT AND AGENTS USEFUL FOR SAME PRANA BIOTECHNOLOGY LIMITED (AU) 2010-03-18 — — US disclosed
WO-2007147217-A1 METHOD OF TREATMENT OF GLIOMA BRAIN TUMOUR PRANA BIOTECHNOLOGY LIMITED (AU) 2007-12-27 — — WO 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-20100069393-A1 METHOD OF TREATMENT AND AGENTS USEFUL FOR SAME MGMT, DHFR, IDH2 CYP3A4 2800/4885CYP2C9 3709/4885CYP2C19 3509/4885

“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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