SCHEMBL3394943

SCHEMBL3394943

CC(=O)Nc1ccc(C(=O)N2CCN(c3ccc(N4CC(N(C)C(O)=S)OC4=O)cc3F)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.49
MAOA P21397 4/20 0.49
LMNA P02545 3/20 0.47
PTGS1 P23219 2/20 0.47
SDHA P31040 2/20 0.47
CALML3 P27482 1/20 0.47
NPY2R P49146 1/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
F10 P00742 1/20 0.40
TSHR P16473 1/20 0.40
FPR1 P21462 1/20 0.39
FPR2 P25090 1/20 0.39
TOP2B Q02880 1/20 0.39

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
SCHEMBL3397573 0.92 MAOB (0.47) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3392358 0.90 MAOB (0.48) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3392669 0.86 MAOB (0.46) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3394985 0.85 MAOB (0.46) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3394944 0.85 MAOB (0.61) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3396925 0.84 MAOB (0.45) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3392294 0.84 MAOB (0.46) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3394642 0.84 MAOB (0.49) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3397572 0.83 MAOB (0.60) MAOBMAOALMNAPTGS1SDHA
SCHEMBL3393360 0.83 MAOB (0.47) MAOBMAOALMNAPTGS1SDHA

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-20100234390-A1 NOVEL COMPOUND AND THEIR USE ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-09-16 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-20100234390-A1 NOVEL COMPOUND AND THEIR USE HTRA1, PRSS1, PRNP MAOB 2054/4885MAOA 2174/4885LMNA 2167/4885

“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.