SCHEMBL25253665

SCHEMBL25253665

Cc1ccc2c(cnn2C2CCCCO2)c1C1CCCc2c(nc(S(C)(=O)=O)nc2N2CCN(C(=O)OC(C)(C)C)CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.39
KRAS P01116 1/20 0.38
MAPT P10636 4/20 0.36
LMNA P02545 3/20 0.36
PIK3CA P42336 2/20 0.36
MTOR P42345 2/20 0.36
PIK3CG P48736 2/20 0.36
ATR Q13535 2/20 0.36
AURKB Q96GD4 1/20 0.36
TP53 P04637 3/20 0.35
CYP3A4 P08684 1/20 0.34

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
SCHEMBL21733530 0.90 KRAS (0.39) GPR119KRASPIK3CAMTORPIK3CG
SCHEMBL25248755 0.89 MAPT (0.36) KRASMAPTLMNAPIK3CAMTOR
SCHEMBL30305242 0.89 MAPT (0.36) KRASMAPTLMNAPIK3CAMTOR
SCHEMBL21243930 0.87 MAPT (0.39) KRASMAPTLMNAPIK3CAMTOR
SCHEMBL21243885 0.84 KRAS (0.41) KRASMAPTLMNAPIK3CAMTOR
SCHEMBL25298889 0.84 KRAS (0.49) KRASTP53
SCHEMBL25298890 0.84 KRAS (0.49) KRASTP53
SCHEMBL30305233 0.84 KRAS (0.49) KRASTP53
SCHEMBL21243863 0.83 KRAS (0.38) KRASMAPTLMNAPIK3CAMTOR
SCHEMBL29253559 0.80 GPR119 (0.38) GPR119KRASMAPTLMNAPIK3CA

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
US-20230212170-A1 INHIBITORS OF KRAS G12C PROTEIN AND USES THEREOF ANTENGENE DISCOVERY LIMITED (CN) 2023-07-06 US disclosed
US-20230212170-A1 INHIBITORS OF KRAS G12C PROTEIN AND USES THEREOF ANTENGENE DISCOVERY LIMITED (CN) 2023-07-06 US disclosed
US-20230212170-A1 INHIBITORS OF KRAS G12C PROTEIN AND USES THEREOF ANTENGENE DISCOVERY LIMITED (CN) 2023-07-06 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-20230212170-A1 INHIBITORS OF KRAS G12C PROTEIN AND USES THEREOF KRAS, NRAS, HRAS GPR119 1855/4885KRAS 1/4885MAPT 3275/4885

“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.