SCHEMBL7375598

SCHEMBL7375598

C[C@H](C(N)=O)N(C(=O)C(CC(=O)N1CCN(C)CC1)Cc1ccccc1)n1ccnc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.43
CHRM1 P11229 5/20 0.41
REN P00797 8/20 0.38
USP7 Q93009 1/20 0.35
LTA4H P09960 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL7335353 0.85 REN (0.38) HSD17B10CHRM1RENALDH1A1
SCHEMBL7337426 0.82 REN (0.38) HSD17B10CHRM1REN
SCHEMBL7330557 0.78 AVPR1A (0.38) HSD17B10CHRM1REN
SCHEMBL7332722 0.77 LMNA (0.38) RENL3MBTL1ALDH1A1
SCHEMBL7332084 0.77 KMT2A (0.43) RENALDH1A1
SCHEMBL9437543 0.76 F2 (0.34) HSD17B10L3MBTL1
SCHEMBL9437442 0.76 CTSS (0.36) RENUSP7
SCHEMBL7330563 0.75 AVPR1A (0.36) HSD17B10CHRM1RENALDH1A1
SCHEMBL9556729 0.75 REN (0.44) HSD17B10CHRM1RENLTA4H
SCHEMBL7329117 0.75 CTSS (0.34) REN

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
US-5258362-A Enzyme inhibitors, amides with oxetane ring ABBOTT LABORATORIES (US) 1993-11-02 US claimed
US-5258362-A Enzyme inhibitors, amides with oxetane ring ABBOTT LABORATORIES (US) 1993-11-02 US disclosed
WO-1992022313-A1 RENIN INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1992-12-23 WO disclosed