SCHEMBL7522385

SCHEMBL7522385

O=CN(Nc1cc(Cl)cc(Cl)c1)c1cccc(N(S(=O)(=O)c2cc(Cl)cc(Cl)c2)S(=O)(=O)c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.40
FBP1 P09467 1/20 0.35
MAPT P10636 4/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HTT P42858 1/20 0.35
VCAM1 P19320 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
USP2 O75604 1/20 0.32
PGR P06401 2/20 0.31
F2 P00734 1/20 0.31
CYP3A4 P08684 1/20 0.30
ACLY P53396 1/20 0.30
CYP19A1 P11511 1/20 0.30

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
SCHEMBL7103725 0.89 PTPRC (0.42) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL7103877 0.88 S1PR1 (0.39) S1PR1VCAM1CYP3A4ACLY
SCHEMBL7518536 0.83 TP53 (0.41) MAPTALDH1A1LMNANPSR1F2
SCHEMBL6836509 0.81 S1PR1 (0.33) S1PR1
SCHEMBL7517997 0.79 S1PR1 (0.44) S1PR1FBP1MAPTALDH1A1LMNA
SCHEMBL7522388 0.73 MAPT (0.57) FBP1MAPTALDH1A1LMNAMEN1
SCHEMBL7513281 0.70 HTR2C (0.47) S1PR1ALDH1A1LMNAMEN1KMT2A
SCHEMBL7518000 0.70 LMNA (0.52) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL7101292 0.69 PGR (0.46) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL7103481 0.67 HTR2C (0.41) S1PR1ALDH1A1LMNAMEN1KMT2A

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-20020127605-A1 Bisubstituted carbocyclic cyclophilin binding compounds and their use GUILFORD PHARMACEUTICALS, INC. 2002-09-12 US claimed
US-20020127605-A1 Bisubstituted carbocyclic cyclophilin binding compounds and their use GUILFORD PHARMACEUTICALS, INC. 2002-09-12 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-20020127605-A1 Bisubstituted carbocyclic cyclophilin binding compounds and their use PPIG, PIN1, PPIH S1PR1 4071/4885FBP1 2934/4885MAPT 1168/4885

“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.