SCHEMBL4792103

SCHEMBL4792103

C[C@H](c1ccccc1)N1C[C@]2(C=O)CC[C@@H](F)[C@@H]2C1=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
GAA P10253 1/20 0.35
MAPK1 P28482 3/20 0.33
CYP2D6 P10635 1/20 0.33
KCNQ3 O43525 1/20 0.32
KCNQ2 O43526 1/20 0.32
KCNQ4 P56696 1/20 0.32
KCNQ5 Q9NR82 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
SCHEMBL4792105 1.00 HSD11B1 (0.40) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL4802761 0.84 HSD11B1 (0.42) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL4794745 0.79 HSD11B1 (0.40) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL4748882 0.74 KMT2A (0.39) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL4748885 0.74 KMT2A (0.39) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL2670427 0.74 KMT2A (0.39) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL2670424 0.74 KMT2A (0.39) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL10289391 0.73 KMT2A (0.42) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL14405521 0.70 KMT2A (0.37) HSD11B1KMT2AALDH1A1HPGDGAA
SCHEMBL4795085 0.68 HSD11B1 (0.43) HSD11B1KMT2AALDH1A1HPGDGAA

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-20120108582-A1 Fused substituted aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED 2012-05-03 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-20120108582-A1 Fused substituted aminopyrrolidine derivative NQO2, QDPR, IL4I1 HSD11B1 3535/4885KMT2A 2847/4885ALDH1A1 2730/4885

“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.