SCHEMBL15499685

SCHEMBL15499685

CC(C)(C)OC(=O)N1C[C@H](OCc2cccc(F)c2)C[C@H]1CO

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.47
GPR119 Q8TDV5 1/20 0.42
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
PRMT8 Q9NR22 1/20 0.41
MAOB P27338 7/20 0.40
MAOA P21397 5/20 0.40
GRM2 Q14416 1/20 0.40
GRM3 Q14832 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
BDKRB2 P30411 1/20 0.39
SPHK2 Q9NRA0 1/20 0.39
SPHK1 Q9NYA1 1/20 0.39
SRC P12931 4/20 0.39
BACE1 P56817 1/20 0.39
BACE2 Q9Y5Z0 1/20 0.39

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
SCHEMBL21996640 0.87 ABCB1 (0.48) ABCB1GPR119SRCBACE1BACE2
SCHEMBL7327353 0.87 ABCB1 (0.58) ABCB1GPR119BDKRB2SRC
SCHEMBL475540 0.87 ABCB1 (0.58) ABCB1GPR119BDKRB2SRC
SCHEMBL3855580 0.87 ABCB1 (0.58) ABCB1GPR119BDKRB2SRC
SCHEMBL71548 0.87 ABCB1 (0.58) ABCB1GPR119BDKRB2SRC
SCHEMBL28995867 0.87 ABCB1 (0.58) ABCB1GPR119BDKRB2SRC
SCHEMBL30421047 0.87 ABCB1 (0.58) ABCB1GPR119BDKRB2SRC
SCHEMBL21996445 0.84 ABCB1 (0.43) ABCB1GPR119MAOBBDKRB2SRC
SCHEMBL15499687 0.84 ABCB1 (0.42) ABCB1GPR119CARM1PRMT6PRMT8
SCHEMBL15499688 0.84 ABCB1 (0.42) ABCB1MAOBMAOABDKRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140066635-A1 Thiophene-2-carboximidamide Based Selective Neuronal Nitric Oxide Inhibitors NORTHWESTERN UNIVERSITY (US) 2014-03-06 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 (1 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-20140066635-A1 Thiophene-2-carboximidamide Based Selective Neuronal Nitric Oxide Inhibitors NOS2, NOS1, NOS3 ABCB1 2151/4885GPR119 518/4885CARM1 1966/4885

“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.