SCHEMBL19983764

SCHEMBL19983764

CNCc1c[nH]c2cc(Nc3ccc(C(F)(F)F)nc3Cl)ccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.38
GPR84 Q9NQS5 2/20 0.35
KCNH2 Q12809 3/20 0.34
LCK P06239 1/20 0.34
PGR P06401 1/20 0.34
CSF1R P07333 1/20 0.34
CHRM2 P08172 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
PDGFRB P09619 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
KIT P10721 1/20 0.34
CHRM1 P11229 1/20 0.34
PDGFRA P16234 1/20 0.34
FLT1 P17948 1/20 0.34
DRD1 P21728 1/20 0.34
TBXA2R P21731 1/20 0.34
SLC6A2 P23975 1/20 0.34
ADORA1 P30542 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL19983854 0.89 APP (0.39) APPGPR84KCNH2LCKPGR
SCHEMBL19983894 0.86 GPR84 (0.39) GPR84KCNH2HTR1ASLC6A4CHRNB2
SCHEMBL19983800 0.84 GPR84 (0.36) APPGPR84KCNH2HTR1ASLC6A4
SCHEMBL16626544 0.82 GPR84 (0.36) GPR84CHRNB2CHRNA7CHRNA4CYP2C9
SCHEMBL19983905 0.81 GPR84 (0.45) GPR84KCNH2SLC6A4CHRNB2CHRNA7
SCHEMBL19983945 0.81 TBXAS1 (0.41) GPR84KCNH2HTR1ASLC6A4TBXAS1
SCHEMBL19984194 0.79 GPR84 (0.39) GPR84HTR1ASLC6A4CHRNB2CHRNA7
SCHEMBL19983847 0.78 TBXAS1 (0.42) GPR84KCNH2HTR1ASLC6A4TBXAS1
SCHEMBL19984128 0.78 TBXAS1 (0.42) GPR84KCNH2HTR1ASLC6A4TBXAS1
SCHEMBL19983989 0.78 GPR84 (0.46) GPR84HTR1ACHRNB2CHRNA7CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed