SCHEMBL8991341

SCHEMBL8991341

NC[C@H]1CN(c2ccc(OCc3ccccc3)c([N+](=O)[O-])c2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
GRM2 Q14416 5/20 0.44
ABCB1 P08183 1/20 0.42
CTSV O60911 3/20 0.42
CTSL P07711 3/20 0.42
F10 P00742 1/20 0.41

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
SCHEMBL7811054 0.92 GRM2 (0.44) POLBGRM2F10
SCHEMBL7829917 0.90 MAOA (0.47) POLBGRM2ABCB1CTSVCTSL
SCHEMBL8991499 0.85 POLB (0.47) POLBGRM2ABCB1
SCHEMBL8991536 0.85 MAOA (0.49) POLBABCB1CTSVCTSLF10
SCHEMBL2837784 0.84 GRM2 (0.47) GRM2F10
SCHEMBL8991532 0.81 ABCB1 (0.44) POLBABCB1CTSVCTSL
SCHEMBL27443061 0.78 POLB (0.45) POLBABCB1CTSVCTSL
SCHEMBL9611100 0.76 GRM2 (0.49) GRM2
SCHEMBL3205152 0.75 GRM2 (0.48) GRM2F10
SCHEMBL3049503 0.75 MAPT (0.59) POLB

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-5529998-A ANTIBACTERIAL MEDICAMENTS BAYER AKTIENGESELLSCHAFT (DE) 1996-06-25 US disclosed
EP-0697412-A1 Benzoxazolyl- and benzo-thiazolyl-oxazolidinones BAYER AG (DE) 1996-02-21 EP disclosed