SCHEMBL21050341

SCHEMBL21050341

CC(C)(C)OC(=O)NNC(=O)C1CCCN1c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.43
CNR2 P34972 5/20 0.43
CNR1 P21554 3/20 0.43
CYP2C8 P10632 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.42
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
THRB P10828 1/20 0.37
ALOX12 P18054 1/20 0.37
MMP8 P22894 2/20 0.36
MMP3 P08254 1/20 0.36

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
SCHEMBL28690247 0.83 CASP3 (0.41) BACE1CNR2CNR1CYP2C8CYP2C19
SCHEMBL19815331 0.81 BACE1 (0.46) BACE1CNR2CNR1CYP2C8CYP2C19
SCHEMBL15665149 0.77 BACE1 (0.47) BACE1CNR2CNR1CYP2C8CYP2C19
SCHEMBL15665466 0.77 BACE1 (0.47) BACE1CNR2CNR1CYP2C8CYP2C19
SCHEMBL19815197 0.76 BACE1 (0.50) BACE1CNR2CNR1CYP2C8CYP2C19
SCHEMBL28793982 0.75 NR3C2 (0.49) NPC1LMNAKMT2AMEN1THRB
SCHEMBL193173 0.73 ABL1 (0.49) LMNANPSR1KMT2AMEN1POLB
SCHEMBL192554 0.73 ABL1 (0.49) LMNANPSR1KMT2AMEN1POLB
SCHEMBL7266914 0.73 GAA (0.43) NPC1LMNANPSR1KMT2AMEN1
SCHEMBL13114884 0.71 AR (0.47) CYP2C19

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-10919851-B2 2-pyrrolidine phenylhydrazides antibacterial agents ABAC Therapeutics, S.L. (ES) 2021-02-16 US disclosed
EP-3490984-B1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS Abac Therapeutics Sl (ES) 2020-09-09 EP disclosed
US-20190177272-A1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS ABAC Therapeutics, S.L. (ES) 2019-06-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190177272-A1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS ATAD2, ATAD2B, ATAD5 BACE1 1885/4885CNR2 2654/4885CNR1 3323/4885
US-10919851-B2 2-pyrrolidine phenylhydrazides antibacterial agents ATAD2, ATAD2B, ATAD5 BACE1 1885/4885CNR2 2654/4885CNR1 3323/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.