SCHEMBL238174

SCHEMBL238174

Cc1cc2ncc3cc(-c4ccc(Cl)cc4)c(-c4ccc([C@]5(N)C[C@@](C)(O)C5)cc4)nc3n2n1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
AKT1 P31749 18/20 0.42
AKT2 P31751 18/20 0.42

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
SCHEMBL2755301 1.00 MEN1 (0.47) MEN1NPC1TP53HPGDRAB9A
SCHEMBL238173 1.00 MEN1 (0.47) MEN1NPC1TP53HPGDRAB9A
SCHEMBL239008 0.93 AKT1 (0.43) AKT1AKT2
SCHEMBL239007 0.93 AKT1 (0.43) AKT1AKT2
SCHEMBL235724 0.92 AKT1 (0.51) AKT1AKT2
SCHEMBL239267 0.92 AKT1 (0.51) AKT1AKT2
SCHEMBL235723 0.92 AKT1 (0.51) AKT1AKT2
SCHEMBL235114 0.91 AKT1 (0.41) MEN1NPC1TP53HPGDRAB9A
SCHEMBL235115 0.91 AKT1 (0.41) MEN1NPC1TP53HPGDRAB9A
SCHEMBL2755304 0.91 AKT1 (0.41) MEN1NPC1TP53HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2406250-B1 INHIBITORS OF AKT ACTIVITY MERCK SHARP & DOHME (US) 2015-08-12 EP claimed
US-8614221-B2 Inhibitors of Akt activity MERCK SHARP & DOHME CORP. (US) 2013-12-24 US claimed
US-20120004240-A1 INHIBITORS OF AKT ACTIVITY MERCK SHARP & DOHME LLC 2012-01-05 US claimed
EP-2406250-B1 INHIBITORS OF AKT ACTIVITY MERCK SHARP & DOHME (US) 2015-08-12 EP disclosed
US-8614221-B2 Inhibitors of Akt activity MERCK SHARP & DOHME CORP. (US) 2013-12-24 US disclosed
US-20120004240-A1 INHIBITORS OF AKT ACTIVITY MERCK SHARP & DOHME LLC 2012-01-05 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-20120004240-A1 INHIBITORS OF AKT ACTIVITY PIK3CD, PIK3CA, PIK3R5 MEN1 1044/4885NPC1 1127/4885TP53 214/4885

“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.