SCHEMBL19984036

SCHEMBL19984036

CNCc1c[nH]c2cc(Cc3ccccc3F)ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
GPR84 Q9NQS5 4/20 0.43
SNCA P37840 2/20 0.43
KMT2A Q03164 3/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MCL1 Q07820 1/20 0.41
HTR2A P28223 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HTR1A P08908 1/20 0.40
HTT P42858 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
SCHEMBL19984023 0.85 HTR2A (0.47) SLC6A2SLC6A4SLC6A3GPR84HTR2A
SCHEMBL19983801 0.80 GPR84 (0.41) SLC6A2SLC6A4SLC6A3GPR84CYP3A4
SCHEMBL19984039 0.79 GPR84 (0.50) SLC6A2SLC6A4SLC6A3GPR84SNCA
SCHEMBL19984035 0.78 HTR2A (0.47) GPR84SNCAKMT2AHTR2AKDM4E
SCHEMBL19984044 0.78 GPR84 (0.40) GPR84CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL11757398 0.77 SLC6A4 (0.53) LMNASLC6A2SLC6A4SLC6A3KMT2A
SCHEMBL31415127 0.77 GPR84 (0.72) GPR84HTR2AHTR1ACHRNB2CHRNA7
SCHEMBL19983829 0.74 HTR2A (0.44) LMNASLC6A2SLC6A4SLC6A3GPR84
SCHEMBL19983951 0.73 TRPV1 (0.41) SLC6A4GPR84KMT2AHTR2AKDM4E
SCHEMBL19983972 0.73 GPR84 (0.40) SLC6A2SLC6A4SLC6A3GPR84KMT2A

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