SCHEMBL2579188

SCHEMBL2579188

COC(Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)O)OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.58
RAB9A P51151 5/20 0.58
NPC1 O15118 3/20 0.58
KDM4E B2RXH2 2/20 0.58
POLB P06746 1/20 0.58
PTPN11 Q06124 1/20 0.48
MAPT P10636 6/20 0.48
TRPM8 Q7Z2W7 1/20 0.48
PTGDR2 Q9Y5Y4 2/20 0.47
ALDH1A1 P00352 4/20 0.47
GAA P10253 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
XDH P47989 1/20 0.46
TARBP2 Q15633 1/20 0.44
ALOX5 P09917 2/20 0.42
LMNA P02545 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42

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
SCHEMBL2580488 0.89 PTPN11 (0.53) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL12154271 0.89 KDM4E (0.58) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL5937234 0.85 SMN1; SMN2 (0.64) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL12344791 0.81 RAB9A (0.67) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL2578444 0.81 SMN1; SMN2 (0.59) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL2580648 0.79 KDM4E (0.62) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL2169817 0.79 RAB9A (0.62) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL2073067 0.78 RAB9A (0.61) SMN1; SMN2RAB9ANPC1KDM4EPOLB
SCHEMBL12154270 0.78 TRPM8 (0.50) RAB9AKDM4EPTPN11MAPTTRPM8
SCHEMBL27839229 0.76 RAB9A (0.59) SMN1; SMN2RAB9ANPC1KDM4EPOLB

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
EP-2089397-B1 5- [4- (AZETIDIN-3-YL0XY) -PHENYL]-2-PHENYL-5H-THIAZ0L0 [5,4-C]PYRIDIN-4-0NE DERIVATIVES AND THEIR USE AS MCH RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2012-08-29 EP disclosed
US-8049013-B2 5- [4-(azetidin-3-yloxy)-phenyl]-2-phenyl-5H-thiazolo[5,4-C] pyridin-4-one derivatives and their use as MCH receptor antagonists ELI LILLY AND COMPANY (US) 2011-11-01 US disclosed
US-20100069352-A1 5- [4-(AZETIDIN-3-YLOXY)-PHENYL]-2-PHENYL-5H-THIAZOLO[5,4-C] PYRIDIN-4-ONE DERIVATIVES AND THEIR USE AS MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2010-03-18 US disclosed
CN-101558075-A 5- [4- (azetidin-3-yl0xy) -phenyl] -2-phenyl-5h-thiaz0l0 [5,4-c] pyridin-4-0ne derivatives and their use as mch receptor antagonists LILLY CO ELI (US) 2009-10-14 CN disclosed
EP-2089397-A1 5- [4- (AZETIDIN-3-YL0XY) -PHENYL]-2-PHENYL-5H-THIAZ0L0 [5,4-C]PYRIDIN-4-0NE DERIVATIVES AND THEIR USE AS MCH RECEPTOR ANTAGONISTS Eli Lilly & Company (US) 2009-08-19 EP disclosed
WO-2008076562-A1 5- [4- (AZETIDIN-3-YL0XY) -PHENYL] -2-PHENYL-5H-THIAZ0L0 [5,4-C] PYRIDIN-4-0NE DERIVATIVES AND THEIR USE AS MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2008-06-26 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-20100069352-A1 5- [4-(AZETIDIN-3-YLOXY)-PHENYL]-2-PHENYL-5H-THIAZOLO[5,4-C] PYRIDIN-4-ONE DERIVATIVES AND THEIR USE AS MCH RECEPTOR ANTAGONISTS MCHR1, MCHR2, HCRTR1 SMN1; SMN2 4012/4885RAB9A 3702/4885NPC1 330/4885

“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.