SCHEMBL5429969

SCHEMBL5429969

N#Cc1ccc(S(=O)(=O)N2CCCC3(CCN(c4ccc(Cl)cc4F)C3=O)C2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP1A2 P05177 1/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPV4 Q9HBA0 14/20 0.38
TRPM8 Q7Z2W7 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
CCR6 P51684 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
SCHEMBL5431189 0.94 USP2 (0.42) USP2CYP3A4CYP2D6CYP1A2MAPT
SCHEMBL5431215 0.89 TRPV4 (0.45) CYP3A4TRPV4TRPM8
SCHEMBL5421695 0.85 USP2 (0.45) USP2CYP3A4CYP2D6CYP1A2MAPT
SCHEMBL5433770 0.84 MAPT (0.37) MAPTKMT2AALDH1A1TSHRKDM4E
SCHEMBL5422092 0.83 TRPV4 (0.46) CYP3A4TRPV4TRPM8
SCHEMBL5431071 0.81 CYP3A4 (0.46) USP2CYP3A4CYP2D6CYP1A2KMT2A
SCHEMBL5421659 0.81 MAPT (0.44) USP2CYP3A4CYP2D6CYP1A2MAPT
SCHEMBL5419790 0.79 CYP3A4 (0.51) USP2CYP3A4CYP2D6CYP1A2KMT2A
SCHEMBL5420713 0.78 CYP3A4 (0.42) USP2CYP3A4CYP2D6CYP1A2KMT2A
SCHEMBL5432042 0.77 LMNA (0.38) USP2MAPTKMT2ANPSR1ALDH1A1

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-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 US disclosed
EP-1683797-A1 HETEROCYCLIC SPIRO COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-26 EP 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-20070275990-A1 Heterocyclic Spiro Compound NR3C2, CBR1, CBR3 USP2 4846/4885CYP3A4 888/4885CYP2D6 208/4885

“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.