SCHEMBL1289901

SCHEMBL1289901

N#CCc1ccc(-c2ccccc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 13/20 0.54
CYP11B2 P19099 13/20 0.54
CYP3A4 P08684 1/20 0.48
LMNA P02545 1/20 0.46
FLT3 P36888 1/20 0.45
LDHA P00338 1/20 0.43
HPGDS O60760 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL25297947 0.85 KMT2A (0.37) CYP11B1CYP11B2FLT3NPC1RAB9A
SCHEMBL6260766 0.79 CYP11B1 (0.46) CYP11B1CYP11B2NPC1RAB9ASMN1; SMN2
SCHEMBL1772141 0.79 KIF11 (0.41) CYP11B1NPC1RAB9ASMN1; SMN2
SCHEMBL31735530 0.78 CYP11B1 (0.41) CYP11B1CYP11B2FLT3LDHANPC1
SCHEMBL2717142 0.76 CYP11B1 (0.59) CYP11B1CYP11B2CYP3A4LDHAHPGDS
SCHEMBL18291876 0.76 CYP11B1 (0.59) CYP11B1CYP11B2CYP3A4LDHAHPGDS
SCHEMBL20122190 0.76 CYP11B1 (0.80) CYP11B1CYP11B2CYP3A4LDHAHPGDS
SCHEMBL1720975 0.76 CYP11B1 (0.59) CYP11B1CYP11B2CYP3A4LDHAHPGDS
SCHEMBL2412899 0.76 CYP11B1 (0.59) CYP11B1CYP11B2CYP3A4LDHAHPGDS
SCHEMBL2411349 0.76 CYP11B1 (0.59) CYP11B1CYP11B2CYP3A4LDHAHPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621925-B1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN MERCK SHARP & DOHME (US) 2017-06-21 EP disclosed
EP-2621925-B1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN MERCK SHARP & DOHME (US) 2017-06-21 EP disclosed
US-8927562-B2 Fused tricyclic inhibitors of mammalian target of rapamycin MERCK SHARP & DOHME CORP. (US) 2015-01-06 US disclosed
US-8927562-B2 Fused tricyclic inhibitors of mammalian target of rapamycin MERCK SHARP & DOHME CORP. (US) 2015-01-06 US disclosed
US-20130281474-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN MERCK SHARP & DOHME CORP. (US) 2013-10-24 US disclosed
US-20130281474-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN MERCK SHARP & DOHME CORP. (US) 2013-10-24 US disclosed
EP-2621925-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN Merck Sharp & Dohme Corp. (US) 2013-08-07 EP disclosed
WO-2012047569-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN SCHERING CORPORATION (US) 2012-04-12 WO disclosed
WO-2012047570-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN SCHERING CORPORATION (US) 2012-04-12 WO disclosed
WO-2012047570-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN SCHERING CORPORATION (US) 2012-04-12 WO disclosed
WO-2012047569-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN SCHERING CORPORATION (US) 2012-04-12 WO 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-20130281474-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN MTOR, RICTOR, RPTOR CYP11B1 3865/4885CYP11B2 4118/4885CYP3A4 4621/4885

“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.