SCHEMBL3394642

SCHEMBL3394642

CSC(=O)N(C)C1CN(c2ccc(N3CCN(C(=O)c4ccc(F)cc4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAOA P21397 3/20 0.46
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 6/20 0.43
ALDH1A1 P00352 5/20 0.43
HPGD P15428 3/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GAA P10253 2/20 0.41
F10 P00742 1/20 0.41
TSHR P16473 2/20 0.40
NPY2R P49146 1/20 0.40
HSP90AA1 P07900 1/20 0.39
KDM4E B2RXH2 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
SCHEMBL3393614 0.94 MAOB (0.46) MAOBMEN1KMT2AMAOALMNA
SCHEMBL3392749 0.93 MAOB (0.47) MAOBMEN1KMT2AMAOALMNA
SCHEMBL3396428 0.88 MAOB (0.46) MAOBMEN1KMT2AMAOALMNA
SCHEMBL3395668 0.86 MAOB (0.50) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3394838 0.85 MAOB (0.51) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3396915 0.85 MAOB (0.52) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3395834 0.85 MAOB (0.46) MAOBKMT2AMAOALMNAPTGS1
SCHEMBL3394891 0.85 F10 (0.56) MAOBF10
SCHEMBL3392358 0.84 MAOB (0.48) MAOBMEN1KMT2AMAOALMNA
SCHEMBL3391785 0.84 MAOB (0.48) MAOBMAOALMNAPTGS1CALML3

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 2 patents. 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 claimed
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 2054/4885MEN1 2861/4885KMT2A 4400/4885

“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.