SCHEMBL6797604

SCHEMBL6797604

CCOC(=O)[C@@H]1CCC[C@H](NC(=O)c2c(-c3c(F)cccc3Cl)noc2C)C1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.57
TP53 P04637 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
GHSR Q92847 1/20 0.57
POLB P06746 3/20 0.55
KMT2A Q03164 5/20 0.54
ALDH1A1 P00352 3/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 2/20 0.53
GAA P10253 1/20 0.53
TSHR P16473 1/20 0.53
ATM Q13315 1/20 0.52
NPC1 O15118 1/20 0.52
MEN1 O00255 1/20 0.51
ALOX15 P16050 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL6636640 0.90 GHSR (0.65) MAPTTP53SMN1; SMN2GHSRPOLB
SCHEMBL6801757 0.88 MAPT (0.45) MAPTTP53SMN1; SMN2GHSRPOLB
SCHEMBL6644582 0.82 MAPT (0.56) MAPTTP53SMN1; SMN2GHSRPOLB
SCHEMBL6069498 0.82 KMT2A (0.48) MAPTTP53SMN1; SMN2GHSRKMT2A
SCHEMBL6642290 0.82 SMN1; SMN2 (0.55) MAPTTP53SMN1; SMN2GHSRPOLB
SCHEMBL6642450 0.82 SMN1; SMN2 (0.55) MAPTSMN1; SMN2GHSRPOLBKMT2A
SCHEMBL6640582 0.81 KMT2A (0.55) MAPTTP53SMN1; SMN2GHSRPOLB
SCHEMBL6640585 0.81 KMT2A (0.55) MAPTTP53SMN1; SMN2GHSRPOLB
SCHEMBL6067824 0.81 MAPT (0.51) MAPTTP53SMN1; SMN2GHSRPOLB
SCHEMBL6636462 0.80 SMN1; SMN2 (0.55) MAPTSMN1; SMN2GHSRPOLBKMT2A

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-20040010005-A1 Stereoselective process for preparing cylcohexyl amine derivatives BARNETT CHARLES JACKSON (US) 2004-01-15 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-20040010005-A1 Stereoselective process for preparing cylcohexyl amine derivatives ALKBH3, AZI2, ALKBH1 MAPT 4576/4885TP53 4705/4885SMN1; SMN2 2439/4885

“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.