SCHEMBL4091225

SCHEMBL4091225

CC(C)(C)C1CCC(C(NC(=O)Nc2ccc(Cl)cc2)c2ccc(C(=O)Nc3ccc4c(c3)OCCO4)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 13/20 0.59
RAB9A P51151 13/20 0.59
MAOB P27338 2/20 0.53
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.47
NAMPT P43490 1/20 0.47
TP53 P04637 3/20 0.46
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
NFKB1 P19838 2/20 0.46
NFKB2 Q00653 2/20 0.46
RELA Q04206 2/20 0.46
PKM P14618 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL4087695 0.94 RAB9A (0.53) NPC1RAB9AMAOBMEN1KMT2A
SCHEMBL4092812 0.88 NPC1 (0.49) NPC1RAB9AMEN1KMT2ANAMPT
SCHEMBL4092673 0.82 CNR1 (0.45) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4085970 0.82 KMT2A (0.51) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL4085792 0.81 MAPT (0.41) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL4081053 0.79 GCGR (0.56)
SCHEMBL4081948 0.79 NPC1 (0.40) NPC1RAB9AKMT2ANAMPTSMN1; SMN2
SCHEMBL4091215 0.76 GCGR (0.59) NPC1RAB9AMAOBPOLBTP53
SCHEMBL4088337 0.76 KMT2A (0.50) MEN1KMT2APOLBALDH1A1PKM
SCHEMBL2662130 0.76 GCGR (0.42) RAB9AMEN1KMT2ATP53LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6875760-B2 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2005-04-05 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 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-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR NPC1 1959/4885RAB9A 2980/4885MAOB 4512/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR NPC1 1959/4885RAB9A 2980/4885MAOB 4512/4885

“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.