SCHEMBL30310686

SCHEMBL30310686

NC(=O)c1nc2c(Cl)cc(Cl)cc2[nH]1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.57
HTT P42858 1/20 0.53
EGLN1 Q9GZT9 1/20 0.46
PRKCZ Q05513 1/20 0.43
F10 P00742 1/20 0.43
CBFB Q13951 1/20 0.42
PARP1 P09874 4/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA1 P30542 1/20 0.40
GRIN1 Q05586 2/20 0.39
RHEB Q15382 1/20 0.38
PARP2 Q9UGN5 1/20 0.37
DHODH Q02127 1/20 0.37
MEN1 O00255 1/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 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
SCHEMBL15939130 1.00 HRH4 (0.57) HRH4HTTEGLN1PRKCZF10
SCHEMBL24020380 0.85 HRH4 (0.58) HRH4HTTEGLN1PRKCZCBFB
SCHEMBL30310503 0.85 HRH4 (0.58) HRH4HTTEGLN1PRKCZCBFB
SCHEMBL24020387 0.80 HRH4 (0.56) HRH4HTTEGLN1PRKCZCBFB
SCHEMBL9587797 0.77 GRIN1 (0.49) HRH4EGLN1PARP1GRIN1RHEB
SCHEMBL24019958 0.76 HRH4 (0.53) HRH4HTTEGLN1PRKCZCBFB
SCHEMBL9589893 0.74 HRH4 (0.36) HRH4F10PARP1RHEBPARP2
SCHEMBL7152026 0.73 HTR3E (0.57) HRH4F10HPGDALOX15KMT2A
SCHEMBL5924441 0.73 HTT (0.61) HRH4HTTEGLN1PRKCZF10
SCHEMBL8872820 0.73 HTT (0.61) HRH4HTTEGLN1PRKCZF10

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-4161902-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2023-04-12 EP disclosed