SCHEMBL24633751

SCHEMBL24633751

CCCC(C)(NC(=O)C(F)(F)F)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 1/20 0.44
EPHX1 P07099 1/20 0.39
ALDH1A1 P00352 2/20 0.36
KDM4C Q9H3R0 1/20 0.35
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CA2 P00918 1/20 0.33
CES2 O00748 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
FAAH O00519 8/20 0.31
CES1 P23141 5/20 0.31
CYP1A2 P05177 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GAA P10253 1/20 0.30
ALOX12 P18054 1/20 0.30
CYP2C19 P33261 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL27028681 1.00 NAALAD2 (0.44) NAALAD2EPHX1ALDH1A1KDM4CPOLB
SCHEMBL24633806 0.89 NAALAD2 (0.44) NAALAD2EPHX1ALDH1A1KDM4CMEN1
SCHEMBL24965167 0.84 SMN1; SMN2 (0.40) NAALAD2EPHX1ALDH1A1KDM4CPOLB
SCHEMBL24965166 0.84 SMN1; SMN2 (0.40) NAALAD2EPHX1ALDH1A1KDM4CPOLB
SCHEMBL202719 0.80 NAALAD2 (0.38) NAALAD2EPHX1ALDH1A1POLBSMN1; SMN2
SCHEMBL8233975 0.78 NAALAD2 (0.37) NAALAD2EPHX1ALDH1A1POLBSMN1; SMN2
SCHEMBL8231008 0.78 NAALAD2 (0.37) NAALAD2EPHX1ALDH1A1POLBSMN1; SMN2
SCHEMBL28959537 0.78 NAALAD2 (0.37) NAALAD2EPHX1ALDH1A1POLBSMN1; SMN2
Hydrochloric Acid SCHEMBL2543241 0.78 NAALAD2 (0.39) NAALAD2EPHX1ALDH1A1POLBSMN1; SMN2
SCHEMBL28641121 0.76 NAALAD2 (0.47) NAALAD2ALDH1A1KDM4CPOLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4603105-A1 PHARMACEUTICAL COMPOSITION CONTAINING CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT AGAINST HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-08-20 EP disclosed
EP-4512818-A1 CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT ON HRAS AND NRAS Chugai Seiyaku Kabushiki Kaisha (JP) 2025-02-26 EP disclosed
US-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-16 US disclosed
EP-4309741-A1 CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-01-24 EP disclosed
WO-2022234853-A1 CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS 中外製薬株式会社 2022-11-10 WO 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-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS KRAS, HRAS, NRAS NAALAD2 1660/4885EPHX1 2849/4885ALDH1A1 4844/4885

“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.