SCHEMBL20619397

SCHEMBL20619397

CCOC(O)c1cc2c(s1)-c1ccc(F)cc1NCC2

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.33
PARP10 Q53GL7 1/20 0.33
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL20599149 0.76 KDM4E (0.57) ALDH1A1GAAMAPT
SCHEMBL20619706 0.72 KDM4E (0.56) ALDH1A1GAAMAPTTSHR
SCHEMBL21474618 0.70 GABRP (0.32)
SCHEMBL20618442 0.69 PARP10 (0.43) PARP1PARP10
SCHEMBL24384849 0.68 BRD4 (0.35) PARP1PARP10ALDH1A1GAAMAPT
SCHEMBL21471796 0.67 MAPK14 (0.47) PARP1PARP10ALDH1A1GAAMAPT
SCHEMBL21471733 0.63 NOTUM (0.33) PARP1PARP10ALDH1A1GAA
SCHEMBL20619601 0.63 KDM4E (0.57) ALDH1A1GAAMAPT
SCHEMBL20619641 0.63 PIK3CA (0.31) PARP1PARP10
SCHEMBL30583047 0.61 PARP10 (0.56) PARP1PARP10ALDH1A1MAPT

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
WO-2019006295-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-01-03 WO disclosed