SCHEMBL3392358

SCHEMBL3392358

CN(C(O)=S)C1CN(c2ccc(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.48
MAOA P21397 3/20 0.47
F10 P00742 6/20 0.43
HSP90AA1 P07900 1/20 0.43
LMNA P02545 4/20 0.43
PTGS1 P23219 1/20 0.43
CALML3 P27482 1/20 0.43
SDHA P31040 1/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
FPR1 P21462 1/20 0.42
FPR2 P25090 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL3392749 0.91 MAOB (0.47) MAOBMAOAF10HSP90AA1LMNA
SCHEMBL3396925 0.90 MAOB (0.45) MAOBMAOAF10LMNAPTGS1
SCHEMBL3394943 0.90 MAOB (0.49) MAOBMAOAF10LMNAPTGS1
SCHEMBL3392669 0.88 MAOB (0.46) MAOBMAOAF10LMNAPTGS1
SCHEMBL3394985 0.87 MAOB (0.46) MAOBMAOAF10LMNAPTGS1
SCHEMBL3392294 0.86 MAOB (0.46) MAOBMAOAF10LMNAPTGS1
SCHEMBL3394628 0.86 HRH4 (0.46) MAOBMAOAF10LMNAPTGS1
SCHEMBL3393360 0.85 MAOB (0.47) MAOBMAOAF10LMNAPTGS1
SCHEMBL3395068 0.84 MAOB (0.51) MAOBMAOAF10LMNAPTGS1
SCHEMBL3394919 0.84 MAOB (0.56) MAOBMAOAF10LMNAPTGS1

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 2174/4885F10 3863/4885

“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.