SCHEMBL7325943

SCHEMBL7325943

CN[C@H]([C]=O)Cc1c[nH]cn1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11116606 0.84 — —
SCHEMBL11801942 0.84 — —
SCHEMBL14660888 0.83 — —
SCHEMBL14058847 0.83 — —
SCHEMBL8481980 0.83 — —
SCHEMBL14058846 0.83 — —
SCHEMBL2184592 0.81 ACACB (0.32) —
SCHEMBL7288407 0.81 ACACB (0.32) —
SCHEMBL4589893 0.80 ACACB (0.34) —
SCHEMBL7614125 0.78 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5140009-A Stable against proteolytic enzymes; anticarcinogenic agents; urogenital disorders TAP PHARMACEUTICALS, INC. (US) 1992-08-18 — — US claimed
EP-0438311-A2 Di- and tripeptide renin inhibitors MERCK & CO. INC. (US) 1991-07-24 — — EP claimed
EP-0417454-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1991-03-20 — — EP claimed
EP-0400065-A4 LHRH ANALOGS — 1991-03-13 — — EP claimed
EP-0413209-A1 LHRH analogs TAP Pharmaceuticals Inc. (US) 1991-02-20 — — EP claimed
EP-0400065-A1 LHRH ANALOGS. ABBOTT LAB (US) 1990-12-05 — — EP claimed
WO-1989007450-A1 LHRH ANALOGS ABBOTT LABORATORIES (US) 1989-08-24 — — WO claimed
EP-0328090-A2 LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 — — EP claimed
WO-1987005302-A1 NOVEL RENIN-INHIBITING PEPTIDES HAVING A DIHYDROXYETHYLENE ISOSTERE TRANSITION STATE INSERT THE UPJOHN COMPANY (US) 1987-09-11 — — WO claimed
EP-0438311-A2 Di- and tripeptide renin inhibitors MERCK & CO. INC. (US) 1991-07-24 — — EP disclosed
EP-0289506-A4 LIPOXYGENASE INHIBITORS — 1990-12-12 — — EP disclosed
EP-0289506-A1 LIPOXYGENASE INHIBITORS CHEMEX PHARMACEUTICALS, INC. (US) 1988-11-09 — — EP disclosed
WO-1988003800-A1 LIPOXYGENASE INHIBITORS CHEMEX PHARMACEUTICALS, INC. (US) 1988-06-02 — — WO disclosed
US-4708964-A Lipoxygenase inhibitors CHEMEX PHARMACEUTICALS (US) 1987-11-24 — — US disclosed
EP-0126344-A2 Tripeptide esters of therapeutic agents ABBOTT LABORATORIES (US) 1984-11-28 — — EP disclosed
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