SCHEMBL411600

SCHEMBL411600

O=C1O[C@@H](COP(=O)(O)O)CN1c1ccc(-c2ccc(N3CCOC3=O)nc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.44
GRM2 Q14416 5/20 0.40
GRM5 P41594 4/20 0.39
MAOA P21397 1/20 0.36
MAOB P27338 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
SCHEMBL411105 0.89 CALML3 (0.51) MAOAMAOB
SCHEMBL412057 0.88 MAOA (0.42) F10MAOAMAOB
SCHEMBL411144 0.86 F10 (0.48) F10MAOAMAOB
SCHEMBL412061 0.86 F10 (0.45) F10GRM2GRM5MAOAMAOB
SCHEMBL411159 0.86 TDO2 (0.39) F10GRM2GRM5MAOAMAOB
SCHEMBL412641 0.85 GRM5 (0.42) GRM2GRM5MAOAMAOB
SCHEMBL411602 0.85 F10 (0.38) F10GRM2GRM5MAOAMAOB
SCHEMBL412791 0.84 GRM5 (0.36) F10GRM5MAOAMAOB
SCHEMBL411610 0.84 GRM2 (0.37) F10GRM2GRM5
SCHEMBL412833 0.82 MAOA (0.36) F10GRM5MAOAMAOB

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-20120065170-A1 Antimicrobial Cyclocarbonyl Heterocyclic Compounds For Treatment Of Bacterial Infections MICURX PHARMACEUTICALS, INC. (KY) 2012-03-15 US disclosed
US-20120065170-A1 Antimicrobial Cyclocarbonyl Heterocyclic Compounds For Treatment Of Bacterial Infections MICURX PHARMACEUTICALS, INC. (KY) 2012-03-15 US disclosed
WO-2012033952-A1 3 - PHENYL- 2 -OXO- 1, 3 -OXAZOLIDINES FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. (KY) 2012-03-15 WO 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-20120065170-A1 Antimicrobial Cyclocarbonyl Heterocyclic Compounds For Treatment Of Bacterial Infections NISCH, SI, VIP F10 3187/4885GRM2 4861/4885GRM5 4129/4885

“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.