SCHEMBL15515124

SCHEMBL15515124

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nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.53
▸ NOD2 Q9HC29 1/20 0.49
▸ HK1 P19367 2/20 0.39
▸ HK2 P52789 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ ESR1 P03372 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ AR P10275 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ TBXA2R P21731 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ ADRA1A P35348 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ LGALS8 O00214 1/20 0.38
▸ SYNJ2 O15056 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ABL1 P00519 1/20 0.37

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
SCHEMBL15504503 1.00 MAPK1 (0.53) MAPK1NOD2HK1HK2NPC1
SCHEMBL15508077 0.93 MAPK1 (0.64) MAPK1NOD2HK1HK2NPC1
SCHEMBL15504330 0.93 MAPK1 (0.64) MAPK1NOD2HK1HK2NPC1
SCHEMBL15514521 0.93 MAPK1 (0.64) MAPK1NOD2HK1HK2NPC1
SCHEMBL15513895 0.93 MAPK1 (0.64) MAPK1NOD2HK1HK2NPC1
SCHEMBL15514519 0.93 MAPK1 (0.64) MAPK1NOD2HK1HK2NPC1
SCHEMBL15504317 0.93 MAPK1 (0.64) MAPK1NOD2HK1HK2NPC1
SCHEMBL15514428 0.91 MAPK1 (0.52) MAPK1NOD2HK1HK2NPC1
SCHEMBL15504325 0.91 MAPK1 (0.52) MAPK1NOD2HK1HK2NPC1
SCHEMBL15504494 0.86 MAPK1 (0.44) MAPK1NOD2NPC1RAB9ALGALS8

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-20140073589-A1 Amphetamine Prodrugs SHIRE AG (CH) 2014-03-13 — — 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 (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-20140073589-A1 Amphetamine Prodrugs SLC6A2, SLC6A3, TAAR5 MAPK1 3205/4885NOD2 3141/4885HK1 2779/4885

“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.

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