SCHEMBL4409235

SCHEMBL4409235

O=CN1C(=O)Cc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.56
NOTUM Q6P988 1/20 0.49
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
KMT2A Q03164 2/20 0.40
CASP3 P42574 1/20 0.40
CASP6 P55212 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HTR7 P34969 4/20 0.40
OPRM1 P35372 3/20 0.40
OPRK1 P41145 3/20 0.40
OPRL1 P41146 3/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
RNASEH1 O60930 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL9179488 0.85 HPGD (0.42) HPGDNOTUMKMT2ATDP1HTR7
SCHEMBL5873731 0.82 HPGD (0.50) HPGDNOTUMDDB1CRBNKMT2A
SCHEMBL31726238 0.82 HPGD (0.50) HPGDNOTUMDDB1CRBNKMT2A
SCHEMBL318501 0.78 NOTUM (0.47) HPGDNOTUMDDB1CRBNKMT2A
SCHEMBL9036500 0.77 MEN1 (0.47) HPGDNOTUMKMT2ATDP1MEN1
SCHEMBL28669819 0.77 HPGD (0.49) HPGDNOTUMDDB1CRBNKMT2A
SCHEMBL29765632 0.74 HPGD (0.59) HPGDNOTUMDDB1CRBNKMT2A
SCHEMBL9954152 0.73 HPGD (0.49) HPGDNOTUMDDB1CRBNKMT2A
SCHEMBL3641405 0.72 HPGD (0.57) HPGDNOTUMDDB1CRBNKMT2A
SCHEMBL1464486 0.72 HPGD (0.57) HPGDNOTUMDDB1CRBNKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009135000-A2 INHIBITION OF SHP2/PTPN11 PROTEIN TYROSINE PHOSPHATASE BY NSC-117199 AND ANALOGS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2009-11-05 WO disclosed
WO-1993012786-A1 INDOLINONE DERIVATIVES HOWARD HARRY R JR (US) 1993-07-08 WO disclosed