SCHEMBL20072590

SCHEMBL20072590

Cc1cc(I)c2nc(CN)c(-c3ccccc3Cl)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.38
DPP4 P27487 7/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
KMT2A Q03164 2/20 0.36
PIK3CD O00329 2/20 0.35
NUDT1 P36639 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
GAA P10253 2/20 0.34
PTGES O14684 1/20 0.34
CNR1 P21554 2/20 0.33
HSD11B1 P28845 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
CNR2 P34972 1/20 0.32

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
SCHEMBL4174846 0.82 DPP4 (0.40) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL4174724 0.77 PIK3CD (0.52) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL4175678 0.77 DPP4 (0.40) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL4174947 0.76 DPP4 (0.44) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL4179102 0.72 DPP4 (0.40) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL4169571 0.72 MAPT (0.48) DPP4KMT2APIK3CDGAAMGAM
SCHEMBL19788621 0.71 DPP4 (0.41) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL4169580 0.71 DPP4 (0.40) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL4178860 0.71 DPP4 (0.44) DPP4KDM4EALDH1A1GLAKMT2A
SCHEMBL19788607 0.69 DPP4 (0.39) DPP4KMT2APIK3CDGAADPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180105532-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2018-04-19 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-20180105532-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 GRM2 2148/4885DPP4 4588/4885KDM4E 1806/4885

“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.