SCHEMBL25508375

SCHEMBL25508375

Cc1cc2c(B3OC(C)(C)C(C)(C)O3)c[nH]c2cc1F

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.39
EGFR P00533 1/20 0.35
JAK2 O60674 2/20 0.33
BTK Q06187 2/20 0.33
GPR84 Q9NQS5 1/20 0.33
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31

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
SCHEMBL29484287 0.78 GPR84 (0.45) IDO1GPR84LPLLIPG
SCHEMBL20595125 0.76 IMPDH2 (0.30)
SCHEMBL30182153 0.76 HTR1D (0.42) IDO1
SCHEMBL29977632 0.74 LPL (0.38) JAK2BTKLPLLIPG
SCHEMBL14816525 0.74 LPL (0.38) JAK2BTKLPLLIPG
SCHEMBL1477757 0.74 LPL (0.38) JAK2BTKLPLLIPG
SCHEMBL25508360 0.72 GPR84 (0.45) GPR84LPLLIPG
SCHEMBL16727198 0.71 GPR84 (0.44) IDO1EGFRGPR84
SCHEMBL29750587 0.71 LPL (0.33) LPLLIPG
SCHEMBL3197383 0.71 CDK4 (0.49) GPR84

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-20230144051-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORPORATION 2023-05-11 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-20230144051-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS KRAS, NRAS, HRAS IDO1 4308/4885EGFR 1111/4885JAK2 1133/4885

“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.