SCHEMBL9616622

SCHEMBL9616622

NC(=O)c1cccc(NC(=O)CCCCCNS(=O)(=O)c2c(Cl)ccc3ccccc23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
HDAC6 Q9UBN7 5/20 0.48
PARP1 P09874 1/20 0.47
PARP10 Q53GL7 1/20 0.47
ALDH1A1 P00352 4/20 0.46
F2 P00734 6/20 0.45
LMNA P02545 1/20 0.44
FABP4 P15090 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
TP53 P04637 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
SCHEMBL9616610 0.79 WDR5 (0.53) MEN1KMT2AHDAC6FABP4HDAC3
SCHEMBL19215380 0.74 MEN1 (1.00) MEN1KMT2AHDAC6PARP1PARP10
SCHEMBL10113624 0.73 MEN1 (0.68) MEN1KMT2AHDAC6PARP1PARP10
SCHEMBL10113893 0.73 MEN1 (0.68) MEN1KMT2AHDAC6PARP1PARP10
SCHEMBL13370421 0.71 MEN1 (0.81) MEN1KMT2AHDAC6PARP1PARP10
SCHEMBL9616673 0.71 WDR5 (0.53) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL9453278 0.70 MEN1 (0.83) MEN1KMT2AHDAC6PARP1PARP10
SCHEMBL882827 0.70 MEN1 (0.83) MEN1KMT2AHDAC6PARP1PARP10
SCHEMBL9616544 0.69 WDR5 (0.67) MEN1KMT2AFABP4MAPT
SCHEMBL14567079 0.69 KMT2A (0.88) MEN1KMT2AHDAC6PARP1PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0462179-A4 NOVEL SULFONAMIDES AS RADIOSENSITIZERS 1992-03-18 EP claimed
EP-0462179-A1 NOVEL SULFONAMIDES AS RADIOSENSITIZERS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-12-27 EP claimed
WO-1990009787-A1 NOVEL SULFONAMIDES AS RADIOSENSITIZERS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-09-07 WO claimed