SCHEMBL3973716

SCHEMBL3973716

CC(C)(C)C(=O)Oc1cn(Cc2ccccc2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
ELANE P08246 12/20 0.44
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RXFP1 Q9HBX9 1/20 0.37
TSHR P16473 1/20 0.37
GRN P28799 1/20 0.36
SORT1 Q99523 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36

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
SCHEMBL431340 0.74 CYP2C19 (0.47) LMNAELANETSHR
SCHEMBL29607284 0.69 ELANE (0.74) LMNAELANE
SCHEMBL13357769 0.68 SIGMAR1 (0.46)
SCHEMBL29954632 0.66 SIGMAR1 (0.39) LMNA
SCHEMBL8380679 0.66 POLB (0.43) ELANE
SCHEMBL28197586 0.66 ELANE (0.70) ELANEL3MBTL1
SCHEMBL28246707 0.65 ALDH1A1 (0.60) LMNAMAPK1L3MBTL1
SCHEMBL3150572 0.65 ELANE (0.57) LMNAELANE
SCHEMBL11315487 0.65 ELANE (0.61) LMNAELANEMAPK1L3MBTL1TSHR
SCHEMBL353268 0.65 NOTUM (0.51) LMNAELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2016078-A2 PYRROLO- AND THIAZOLO-PYRIDINE COMPOUNDS AS HIF MODULATORS FIBROGEN, INC. (US) 2009-01-21 EP disclosed
WO-2007115315-A2 PYRROLO- AND THIAZOLO-PYRIDINE COMPOUNDS AS HIF MODULATORS FIBROGEN, INC. (US) 2007-10-11 WO disclosed