SCHEMBL5635019

SCHEMBL5635019

NC(=O)N1CCN(S(=O)(=O)c2ccccc2)C(C(N)=O)(C(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
ALDH1A1 P00352 2/20 0.38
CYP2D6 P10635 2/20 0.38
KMT2A Q03164 2/20 0.38
USP2 O75604 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
GAA P10253 2/20 0.38
LMNA P02545 2/20 0.37
NPC1 O15118 1/20 0.37
PKM P14618 1/20 0.37
CNR1 P21554 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36

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
SCHEMBL4037687 0.80 GAA (0.45) MAPTALDH1A1KMT2ACYP3A4GAA
SCHEMBL4036536 0.78 MAPT (0.45) MAPTNPSR1ALDH1A1CYP2D6KMT2A
SCHEMBL4036561 0.68 FAAH (0.38) MAPTNPSR1KMT2ACA2
SCHEMBL4034457 0.68 GAA (0.39) MAPTNPSR1ALDH1A1KMT2AUSP2
SCHEMBL5635771 0.66 OPRD1 (0.36) NPSR1ALDH1A1CYP2D6KMT2ACYP3A4
SCHEMBL5624203 0.61 KMT2A (0.70) MAPTNPSR1ALDH1A1KMT2AUSP2
SCHEMBL3768575 0.61 ALDH1A1 (0.63) ALDH1A1CYP2D6KMT2AUSP2GAA
SCHEMBL28400470 0.60 MAPT (0.60) MAPTNPSR1ALDH1A1CYP2D6KMT2A
SCHEMBL1000444 0.60 MAPT (0.64) MAPTNPSR1ALDH1A1CYP2D6KMT2A
SCHEMBL6744239 0.59 ALDH1A1 (0.71) ALDH1A1CYP2D6KMT2AUSP2GAA

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-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 US claimed

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-20070142391-A1 Piperazine-2-carboxamide derivatives P2RX5, P2RX2, NPY5R MAPT 4555/4885NPSR1 402/4885ALDH1A1 610/4885

“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.