SCHEMBL15076927

SCHEMBL15076927

CNC(=O)c1cc(-n2nc(C)c(C(=O)O)c2C)ccn1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.44
▸ RAB9A P51151 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ BAZ2B Q9UIF8 1/20 0.40
▸ ALKBH1 Q13686 1/20 0.40
▸ WNT3A P56704 1/20 0.40
▸ POLB P06746 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ EGLN1 Q9GZT9 1/20 0.39
▸ HPGD P15428 1/20 0.38

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
SCHEMBL15076969 0.87 NPC1 (0.44) LMNARAB9ANPC1ALKBH1WNT3A
SCHEMBL15076929 0.86 LMNA (0.47) LMNARAB9ANPC1ALKBH1POLB
SCHEMBL2938583 0.72 MEN1 (0.69) RAB9ANPC1WNT3APOLBMAPT
SCHEMBL2201331 0.70 LMNA (0.60) LMNARAB9APOLBMAPTNPSR1
SCHEMBL2201890 0.70 LMNA (0.64) LMNARAB9ANPC1POLBMAPT
SCHEMBL2197832 0.69 EGLN1 (0.54) LMNARAB9ANPC1POLBMAPT
SCHEMBL27920237 0.69 KMT2A (0.63) LMNARAB9ANPC1MAPTNPSR1
SCHEMBL23405316 0.69 ANO1 (0.47) RAB9ANPC1MEN1KMT2A
SCHEMBL29830791 0.69 FTO (0.67) MAPTEGLN1
SCHEMBL19439262 0.69 FTO (0.67) MAPTEGLN1

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-20130165464-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 — — 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-20130165464-A1 HETEROARYLS AND USES THEREOF PIK3C2B, PI4KB, PIK3R4 LMNA 3432/4885RAB9A 119/4885NPC1 819/4885

“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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