SCHEMBL10262159

SCHEMBL10262159

COCCNC(=O)Nc1cccc(C(=O)c2c[nH]c3ncc(-c4ccccn4)cc23)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AXL P30530 4/20 0.58
AAK1 Q2M2I8 1/20 0.47
RIPK1 Q13546 4/20 0.46
IGF1R P08069 4/20 0.42
NPC1 O15118 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPK1 P28482 1/20 0.41
TGFBR1 P36897 1/20 0.41
BRD4 O60885 1/20 0.41
BDKRB1 P46663 1/20 0.40
CNR1 P21554 1/20 0.40
NEK1 Q96PY6 1/20 0.40

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
SCHEMBL414199 0.88 NEK1 (0.51) AXLAAK1RIPK1IGF1RBRD4
SCHEMBL416743 0.86 MAP2K1 (0.48) NPC1TSHRRAB9ASMN1; SMN2BDKRB1
SCHEMBL415532 0.85 PYGL (0.47) AAK1RIPK1IGF1RMAPK1BDKRB1
SCHEMBL20090438 0.77 RIPK1 (0.40) AAK1RIPK1IGF1RNPC1TSHR
SCHEMBL12769509 0.77 AXL (0.52) AXLSMN1; SMN2CNR1
SCHEMBL412504 0.77 CDK8 (0.54) AAK1RIPK1IGF1RTSHRBRD4
SCHEMBL413734 0.74 TSHR (0.52) AAK1RIPK1IGF1RNPC1TSHR
SCHEMBL416381 0.74 CDK8 (0.50) RIPK1NPC1RAB9ASMN1; SMN2
SCHEMBL416393 0.74 CDK8 (0.51) AAK1RIPK1IGF1R
SCHEMBL416103 0.73 RIPK1 (0.59) AXLAAK1RIPK1IGF1RBRD4

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-20120022098-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2012-01-26 US disclosed
US-20120022098-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2012-01-26 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-20120022098-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 AXL 1354/4885AAK1 335/4885RIPK1 507/4885

“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.