SCHEMBL89125

SCHEMBL89125

Cc1nc(-c2ccccc2)nc(C)c1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.60
LMNA P02545 3/20 0.59
BRD4 O60885 3/20 0.52
BRD2 P25440 1/20 0.52
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HTT P42858 2/20 0.50
MEN1 O00255 1/20 0.50
KDM4E B2RXH2 2/20 0.49
POLB P06746 2/20 0.48
ADORA3 P0DMS8 1/20 0.48
ADORA2A P29274 1/20 0.48
ADORA2B P29275 1/20 0.48
ADORA1 P30542 1/20 0.48
CHEK1 O14757 1/20 0.47
AKT2 P31751 1/20 0.47
ALDH1A1 P00352 2/20 0.46
GLA P06280 1/20 0.46

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
SCHEMBL13910152 0.92 NPC1 (0.53) L3MBTL1LMNABRD4BRD2RAB9A
SCHEMBL13910155 0.92 NPC1 (0.53) L3MBTL1LMNABRD4BRD2RAB9A
SCHEMBL13910151 0.90 NPC1 (0.51) L3MBTL1LMNABRD4BRD2RAB9A
SCHEMBL10205901 0.87 ADK (0.53) L3MBTL1LMNABRD4BRD2RAB9A
SCHEMBL26167674 0.86 LMNA (0.70) L3MBTL1LMNABRD4BRD2RAB9A
SCHEMBL13700991 0.86 LMNA (0.55) L3MBTL1LMNABRD4BRD2RAB9A
SCHEMBL10083704 0.83 L3MBTL1 (0.62) L3MBTL1LMNARAB9ANPC1KMT2A
SCHEMBL13910160 0.81 NPC1 (0.56) L3MBTL1LMNARAB9ANPC1KMT2A
SCHEMBL13910162 0.81 NPC1 (0.56) L3MBTL1LMNARAB9ANPC1KMT2A
SCHEMBL16189083 0.80 LMNA (0.49) L3MBTL1LMNABRD4RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383650-B2 Organic compounds NOVARTIS AG (CH) 2013-02-26 US disclosed
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
US-20080319018-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-12-25 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 (2 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-20090192148-A1 Organic Compounds REN, ACE, AGTR1 L3MBTL1 3031/4885LMNA 1594/4885BRD4 603/4885
US-20080319018-A1 ORGANIC COMPOUNDS REN, ACE, AGTR1 L3MBTL1 1772/4885LMNA 2118/4885BRD4 1415/4885

“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.