SCHEMBL26323883

SCHEMBL26323883

Cc1cc(C(F)(F)F)cn(C(C)(C)C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
XPO1 O14980 2/20 0.39
KRAS P01116 1/20 0.34
SOS1 Q07889 1/20 0.34
RXFP1 Q9HBX9 3/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 1/20 0.33
NOTUM Q6P988 2/20 0.33
ALDH1A1 P00352 2/20 0.31
MAPK1 P28482 1/20 0.31
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
PDE2A O00408 2/20 0.30
KDM4E B2RXH2 1/20 0.30
AGBL2 Q5U5Z8 1/20 0.30

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
SCHEMBL18997317 0.81 KMT2A (0.42) RXFP1LMNAALDH1A1MAPK1MEN1
SCHEMBL16589301 0.78 RAPGEF4 (0.36) ALDH1A1MEN1KMT2A
SCHEMBL15616926 0.76 BRD4 (0.47) XPO1RXFP1
SCHEMBL15616944 0.73 RXFP1 (0.42) XPO1RXFP1MAPTLMNAALDH1A1
SCHEMBL25745842 0.69 TYR (0.40) XPO1RXFP1MAPTLMNAALDH1A1
SCHEMBL24565768 0.68 BRD4 (0.45) XPO1RXFP1LMNAALDH1A1MAPK1
SCHEMBL10460879 0.67 L3MBTL1 (0.40) XPO1RXFP1LMNAALDH1A1MAPK1
SCHEMBL24007756 0.66 ALDH1A1 (0.41) RXFP1MAPTLMNAALDH1A1MAPK1
SCHEMBL23957950 0.65 MEN1 (0.37) MAPTALDH1A1MEN1KMT2A
SCHEMBL16019374 0.65 CA2 (0.39) KRASSOS1RXFP1MAPTLMNA

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-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease SHY Therapeutics LLC 2023-09-14 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-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease MAPK6, MAP3K6, MAPK4 XPO1 1855/4885KRAS 608/4885SOS1 2906/4885

“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.