SCHEMBL29344172

SCHEMBL29344172

Cc1cc(C)c(I)c(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPK1 P28482 1/20 0.50
POLB P06746 3/20 0.48
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KDM4E B2RXH2 1/20 0.32
APOBEC3G Q9HC16 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
SCHEMBL26608375 0.81 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1MAPK1POLBHTT
SCHEMBL21223482 0.77 NOS3 (0.38) POLB
SCHEMBL30915338 0.77 NOS3 (0.38) POLB
SCHEMBL26841823 0.75 KDM4E (0.37) SMN1; SMN2ALDH1A1MAPK1POLBHPGD
SCHEMBL10412021 0.75 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1MAPK1POLBHTT
SCHEMBL10411734 0.75 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1MAPK1POLBHTT
SCHEMBL10412144 0.71 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPK1POLBHTT
SCHEMBL22251108 0.71 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPK1POLBHTT
SCHEMBL14853025 0.71 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPK1POLBHTT
SCHEMBL29513014 0.71 POLB (0.53) SMN1; SMN2ALDH1A1MAPK1POLBHTT

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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-18 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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT KRAS, NRAS, HRAS SMN1; SMN2 1713/4885ALDH1A1 2871/4885MAPK1 332/4885

“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.