SCHEMBL31084034

SCHEMBL31084034

[O-][S@+]1CCc2nc(N3CCC(O)(c4ccc(Cl)cc4)C3)nc(NC3(CO)CCC3)c21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TACR2 P21452 1/20 0.32
▸ OPRM1 P35372 1/20 0.31
▸ OPRL1 P41146 1/20 0.31
▸ DRD4 P21917 1/20 0.30
▸ CCR3 P51677 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
SCHEMBL31002943 0.94 — —
SCHEMBL8054895 0.91 TACR2 (0.37) TACR2OPRM1OPRL1DRD4CCR3
SCHEMBL31083986 0.87 — —
SCHEMBL31084040 0.84 PIK3R1 (0.30) —
SCHEMBL8058848 0.84 DRD2 (0.32) DRD4
SCHEMBL31083977 0.84 PIK3R1 (0.31) —
SCHEMBL588844 0.83 CETP (0.34) DRD4
SCHEMBL31083993 0.83 PIK3R1 (0.31) —
SCHEMBL31084027 0.83 TRPV3 (0.34) —
SCHEMBL31084089 0.83 — —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4674852-A1 PREPARATION METHOD FOR AND USE OF DIHYDROTHIENOPYRIMIDINE DERIVATIVE Innovstone Therapeutics Limited (CN) 2026-01-07 — — EP disclosed
CN-118871444-A Preparation method and application of dihydro-thienopyrimidine derivative 上海翊石医药科技有限公司 2024-10-29 — — CN disclosed
WO-2024179493-A1 PREPARATION METHOD FOR AND USE OF DIHYDROTHIENOPYRIMIDINE DERIVATIVE 上海翊石医药科技有限公司 2024-09-06 — — WO disclosed
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