SCHEMBL2589646

SCHEMBL2589646

Cc1nn(C(N)=O)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 0.59
TAAR1 Q96RJ0 1/20 0.48
LMNA P02545 1/20 0.46
UBE2N P61088 1/20 0.46
GLS O94925 1/20 0.44
F2 P00734 3/20 0.41
PLAU P00749 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.40
CTRB1 P17538 1/20 0.40

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
SCHEMBL726679 0.84 ELANE (0.60) ELANETAAR1LMNAUBE2NGLS
SCHEMBL1514915 0.84 ELANE (0.60) ELANETAAR1UBE2NGLSF2
SCHEMBL27342474 0.79 ELANE (0.56) ELANETAAR1LMNAUBE2NGLS
SCHEMBL5989502 0.79 ELANE (0.73) ELANEF2PLAU
SCHEMBL14863708 0.79 ELANE (0.47) ELANELMNAF2PLAUPOLB
SCHEMBL28136631 0.78 ALOX15 (0.47) ELANEF2PLAU
SCHEMBL28136630 0.78 ELANE (0.44) ELANEF2PLAUPOLB
SCHEMBL960949 0.77 ELANE (0.62) ELANEF2PLAU
SCHEMBL2932427 0.77 ELANE (0.38) ELANETAAR1LMNAUBE2N
SCHEMBL14193572 0.77 ELANE (0.54) ELANETAAR1UBE2NGLSF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102933575-B Yclohexyl-azetidinyl antagonists of CCR2 JANSSEN PHARMACEUTICA NV 2015-02-04 CN disclosed
EP-2566328-A1 INDAZOLES GlaxoSmithKline LLC (US) 2013-03-13 EP disclosed
CN-102933575-A Yclohexyl-azetidinyl antagonists of ccr2 JANSSEN PHARMACEUTICA NV 2013-02-13 CN disclosed
WO-2011140325-A1 INDAZOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 WO disclosed