SCHEMBL7793462

SCHEMBL7793462

CCN1CCN(c2ccc(C(=O)OC)cc2)CC1.COC(=O)c1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
ALDH1A1 P00352 5/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C19 P33261 1/20 0.55
TSHR P16473 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HTT P42858 2/20 0.54
MAPK10 P53779 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
REV1 Q9UBZ9 1/20 0.53
LMNA P02545 3/20 0.53
MAPK1 P28482 1/20 0.53
HSD17B10 Q99714 1/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.52
TP53 P04637 1/20 0.52
RAB9A P51151 1/20 0.52

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
SCHEMBL63849 0.93 ALDH1A1 (0.61) MAPTALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL7903765 0.82 MAPT (0.67) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL4652187 0.82 DRD2 (0.61) MAPTALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL2943824 0.80 KMT2A (0.61) MAPTALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL63447 0.79 MAPT (0.60) MAPTALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL5787289 0.78 MAPT (0.59) MAPTALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL14699472 0.77 RAB9A (0.65) MAPTALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL14699470 0.77 RAB9A (0.65) MAPTALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL29389567 0.77 BRD4 (0.60)
SCHEMBL28705082 0.77 BRD4 (0.60)

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-20010016207-A1 Dipeptide nitrile cathepsin K inhibitors NOVARTIS AG (CH) 2001-08-23 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-20010016207-A1 Dipeptide nitrile cathepsin K inhibitors CTSK, CTSC, CTSS MAPT 4707/4885ALDH1A1 2798/4885CYP1A2 1945/4885

“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.