SCHEMBL31095709

SCHEMBL31095709

OCc1sc2cc(Br)ccc2c1F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EPM2A O95278 1/20 0.31
▸ PTPN2 P17706 1/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ PTPN22 Q9Y2R2 1/20 0.31
▸ CYP2A6 P11509 1/20 0.30
▸ HSP90AA1 P07900 1/20 0.30
▸ CHEK1 O14757 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
SCHEMBL31095746 0.86 EPM2A (0.40) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL31095644 0.84 CYP2A6 (0.31) CYP2A6HSP90AA1
SCHEMBL20558956 0.82 BCKDK (0.42) —
SCHEMBL10858277 0.79 TBXAS1 (0.36) CYP2A6CHEK1
SCHEMBL10855114 0.79 ASIC3 (0.40) —
SCHEMBL18770003 0.76 CYP2A6 (0.34) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL18769968 0.73 MIF (0.37) EPM2APTPN2PTPN1PTPN22HSP90AA1
SCHEMBL16693177 0.71 BCKDK (0.50) —
SCHEMBL31095666 0.70 EPM2A (0.38) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL29644557 0.70 RAB9A (0.41) EPM2APTPN2PTPN1PTPN22CYP2A6

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
EP-4680247-A1 DPP1 INHIBITORS WITH POLYCYCLIC LINKERS AND USES THEREOF Insmed Incorporated (US) 2026-01-21 — — EP disclosed
WO-2024192416-A1 DPP1 INHIBITORS WITH POLYCYCLIC LINKERS AND USES THEREOF INSMED INCORPORATED (US) 2024-09-19 — — WO disclosed
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