SCHEMBL6314422

SCHEMBL6314422

COc1cccc(Nc2ncc(-c3cnc4ccccc4c3)c(N)n2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 4/20 0.60
KDR P35968 2/20 0.52
CDK1 P06493 1/20 0.52
USP2 O75604 6/20 0.50
CYP1A2 P05177 6/20 0.50
CLK4 Q9HAZ1 4/20 0.50
CYP3A4 P08684 3/20 0.50
SYK P43405 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALPL P05186 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 3/20 0.48
ALDH1A1 P00352 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
CCNA2 P20248 1/20 0.47
CDK2 P24941 1/20 0.47
CDK5 Q00535 1/20 0.47
CDK5R1 Q15078 1/20 0.47

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
SCHEMBL6312590 0.91 IGF1R (0.58) IGF1RKDRCDK1ALPLLMNA
SCHEMBL6318900 0.90 IGF1R (0.58) IGF1RKDRCDK1CYP1A2CYP3A4
SCHEMBL6321069 0.88 IGF1R (0.53) IGF1RKDRCDK1USP2CYP1A2
SCHEMBL6318975 0.87 IGF1R (0.62) IGF1RSYKALPLCDK2EGFR
SCHEMBL6312056 0.86 IGF1R (0.60) IGF1RKDRMEN1KMT2ACDK2
SCHEMBL6312806 0.85 IGF1R (0.47) IGF1RKDRCDK2EGFRPIK3CA
SCHEMBL6312119 0.83 NPC1 (0.47) IGF1RKDRUSP2ALPLMEN1
SCHEMBL2205447 0.83 IGF1R (0.63) IGF1RKDRCDK2EGFRAURKA
SCHEMBL6312636 0.83 CDK5 (0.47) IGF1RSYKMEN1KMT2ACDK5
SCHEMBL6319833 0.83 LRRK2 (0.46) IGF1RKDRMEN1KMT2ALMNA

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-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US claimed
US-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. 2004-04-01 US claimed

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-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use DPYD, TYMP, TPMT IGF1R 4054/4885KDR 2148/4885CDK1 992/4885

“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.