SCHEMBL207979

SCHEMBL207979

Cc1nc(CN2CCN(c3c(Cl)cnc4[nH]c(-c5ccc(CN6CCN(C(=O)O)CC6)cc5)nc34)CC2)cs1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AURKA O14965 13/20 0.43
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNH2 Q12809 1/20 0.39
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
AURKB Q96GD4 2/20 0.38
CYP2C19 P33261 1/20 0.38
FLT3 P36888 1/20 0.38
CYP3A4 P08684 1/20 0.38
AURKC Q9UQB9 1/20 0.38
FGFR1 P11362 1/20 0.38
FGFR2 P21802 1/20 0.38
FGFR4 P22455 1/20 0.38
FGFR3 P22607 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
SCHEMBL209623 0.92 AURKA (0.45) AURKAKMT2A
SCHEMBL2732785 0.90 TBK1 (0.41) AURKAKMT2AALDH1A1SMN1; SMN2
SCHEMBL211684 0.89 AURKA (0.48) AURKAKCNH2CYP2D6CYP2C9AURKB
SCHEMBL208033 0.88 AURKA (0.49) AURKAKCNH2
SCHEMBL207811 0.85 AURKA (0.51) AURKAKMT2AALDH1A1SMN1; SMN2KCNH2
SCHEMBL14495704 0.85 AURKA (0.43) AURKAKCNH2FLT3
SCHEMBL13985589 0.85 AURKA (0.42) AURKAKMT2AALDH1A1SMN1; SMN2KCNH2
SCHEMBL209261 0.84 AURKA (0.47) AURKACYP2D6CYP2C9AURKBCYP2C19
SCHEMBL209500 0.84 AURKA (0.58) AURKAKCNH2FLT3
SCHEMBL13985663 0.83 AURKA (0.48) AURKAKCNH2FLT3FGFR1FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963315-B1 ENZYME INHIBITORS CANCER REC TECH LTD (GB) 2014-10-08 EP disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 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 (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-20090247507-A1 Enzyme Inhibitors AURKC, AURKB, AURKA AURKA 3/4885KMT2A 384/4885ALDH1A1 3015/4885

“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.