SCHEMBL26331256

SCHEMBL26331256

Cc1c(F)ccc(NN)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
FABP3 P05413 1/20 0.32
FABP4 P15090 1/20 0.32
ALDH1A1 P00352 2/20 0.30
POLB P06746 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
AURKA O14965 1/20 0.30
DAPK3 O43293 1/20 0.30
JAK2 O60674 1/20 0.30
PRKD3 O94806 1/20 0.30
MAP4K4 O95819 1/20 0.30
PAK4 O96013 1/20 0.30
NTRK1 P04629 1/20 0.30
CSF1R P07333 1/20 0.30
RET P07949 1/20 0.30
IGF1R P08069 1/20 0.30
MET P08581 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
SCHEMBL2502593 0.79 ALDH1A1 (0.47) ALDH1A1POLBTDP1L3MBTL1GAA
SCHEMBL22792410 0.78 FABP3 (0.33) FABP3FABP4ALDH1A1POLBTDP1
Hydrochloric Acid SCHEMBL840283 0.77 ALDH1A1 (0.46) ALDH1A1POLBTDP1L3MBTL1GAA
SCHEMBL384037 0.76 ACHE (0.42) CA9ALDH1A1TDP1GAA
SCHEMBL3700950 0.75 POLB (0.33) ALDH1A1POLB
Hydrochloric Acid SCHEMBL9630416 0.73 POLB (0.32) ALDH1A1POLBTDP1L3MBTL1
SCHEMBL10981989 0.71 MAPT (0.42) CA1CA2CA9ALDH1A1POLB
SCHEMBL27519823 0.71 FABP3 (0.33) FABP3FABP4
SCHEMBL18332199 0.70 ALDH1A1 (0.40) ALDH1A1GAA
SCHEMBL358555 0.70 ALDH1A1 (0.41) CA1CA2CA9ALDH1A1POLB

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-20230295114-A1 AKT3 MODULATORS Georgiamune Inc. 2023-09-21 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-20230295114-A1 AKT3 MODULATORS AKT3, AKT2, MTOR CA1 3368/4885CA2 3249/4885CA9 4253/4885

“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.