SCHEMBL25402147

SCHEMBL25402147

O=C(Nc1ccc(I)cc1)N[C@H]1CCN(C(=O)O)C1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.65
EPHX1 P07099 2/20 0.59
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
CTSS P25774 1/20 0.51
CTSC P53634 1/20 0.51
USP30 Q70CQ3 2/20 0.49
DPP4 P27487 1/20 0.48
KCNH2 Q12809 1/20 0.48
DPP7 Q9UHL4 1/20 0.48

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
SCHEMBL27101806 1.00 EPHX2 (0.65) EPHX2EPHX1CTSLCTSBCTSS
SCHEMBL26554653 0.82 CA12 (0.61) EPHX2EPHX1USP30
SCHEMBL27100904 0.81 CYP1A2 (0.57) CTSLCTSBCTSSCTSCUSP30
SCHEMBL25403939 0.81 CYP1A2 (0.57) CTSLCTSBCTSSCTSCUSP30
SCHEMBL25400740 0.81 CYP1A2 (0.57) CTSLCTSBCTSSCTSCUSP30
SCHEMBL18307140 0.79 EPHX1 (0.84) EPHX2EPHX1DPP4KCNH2DPP7
SCHEMBL2728845 0.79 EPHX2 (1.00) EPHX2
SCHEMBL23390333 0.78 PTPN1 (0.52) EPHX2
SCHEMBL3960592 0.78 EPHX2 (0.72) EPHX2EPHX1
SCHEMBL27577307 0.78 EPHX2 (0.72) EPHX2EPHX1USP30

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-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2023-10-19 US disclosed
EP-4211111-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY University of Virginia Patent Foundation (US) 2023-07-19 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-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY SPNS2, SPCS2, SMN1; SMN2 EPHX2 1688/4885EPHX1 3679/4885CTSL 4052/4885

“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.