SCHEMBL13601409

SCHEMBL13601409

Cc1cc(-c2nc(-c3ccc4c(c3)CN([C@H]3C[C@H](C(=O)O)C3)C4)no2)cc(C)c1-c1cccc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 15/20 0.41
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
S1PR1 P21453 4/20 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
SCHEMBL13608721 1.00 GRM5 (0.41) GRM5NPC1TP53RAB9ASMN1; SMN2
SCHEMBL13601436 0.91 S1PR1 (0.43) S1PR1
SCHEMBL13601406 0.91 S1PR1 (0.43) S1PR1
SCHEMBL13608820 0.91 S1PR1 (0.43) GRM5NPC1TP53RAB9ASMN1; SMN2
SCHEMBL13601398 0.91 S1PR1 (0.43) GRM5NPC1TP53RAB9ASMN1; SMN2
SCHEMBL13601410 0.89 NR1H4 (0.44) NPC1RAB9ASMN1; SMN2S1PR1
SCHEMBL13601412 0.86 S1PR1 (0.43) NPC1RAB9ASMN1; SMN2S1PR1
SCHEMBL13601425 0.86 NPC1 (0.43) NPC1RAB9ASMN1; SMN2S1PR1
SCHEMBL13601900 0.86 S1PR1 (0.39) GRM5NPC1RAB9AS1PR1
SCHEMBL13608470 0.86 S1PR1 (0.39) GRM5NPC1RAB9AS1PR1

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-20090298894-A1 AMINO ACID COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2009-12-03 US disclosed
US-20090298894-A1 AMINO ACID COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2009-12-03 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-20090298894-A1 AMINO ACID COMPOUNDS S1PR1, S1PR2, S1PR5 GRM5 1282/4885NPC1 691/4885TP53 3116/4885

“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.