SCHEMBL5637686

SCHEMBL5637686

NC(=O)Nc1ccc(-c2nnc(CSCCOc3ccccc3)o2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 5/20 0.48
NPC1 O15118 5/20 0.48
ALDH1A1 P00352 4/20 0.48
RAB9A P51151 4/20 0.48
KDM4E B2RXH2 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HPGD P15428 3/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
TP53 P04637 2/20 0.47
POLB P06746 3/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
LMNA P02545 1/20 0.44
HSD17B10 Q99714 3/20 0.43
USP2 O75604 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL5638483 0.88 MAPT (0.52) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL5637398 0.87 MEN1 (0.53) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL5640405 0.86 MEN1 (0.52) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL5640100 0.86 PARP10 (0.51) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL14499647 0.85 MEN1 (0.48) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL5637000 0.85 MEN1 (0.48) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL14499602 0.84 KMT2A (0.48) MEN1KMT2AMAPTNPC1ALDH1A1
Oxalic Acid SCHEMBL5637959 0.84 PARP10 (0.49) MEN1KMT2AMAPTNPC1ALDH1A1
Oxalic Acid SCHEMBL5637962 0.84 MAPT (0.50) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL14499603 0.84 NPC1 (0.48) MEN1KMT2AMAPTNPC1ALDH1A1

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
US-7229987-B2 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes ELI LILLY AND COMPANY (US) 2007-06-12 US disclosed
US-7229987-B2 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes ELI LILLY AND COMPANY (US) 2007-06-12 US disclosed
US-7229987-B2 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes ELI LILLY AND COMPANY (US) 2007-06-12 US disclosed
US-20050272718-A1 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes AMMENN ET AL, JOCHEN 2005-12-08 US disclosed
EP-1505968-A1 MULTICYCLIC COMPOUNDS FOR USE AS MELANIN CONCENTRATING HORMONE ANTAGONISTS IN THE TREATMENT OF OBESITY AND DIABETES ELI LILLY AND COMPANY (US) 2005-02-16 EP disclosed
WO-2003097047-A1 MULTICYCLIC COMPOUNDS FOR USE AS MELANIN CONCENTRATING HORMONE ANTAGONISTS IN THE TREATMENT OF OBESITY AND DIABETES ELI LILLY AND COMPANY (US) 2003-11-27 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-20050272718-A1 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes MC1R, MC4R, MC5R MEN1 494/4885KMT2A 2662/4885MAPT 2221/4885

“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.