SCHEMBL7837434

SCHEMBL7837434

Cc1nc2ccc(C(=O)O)nc2n1Cc1cc([N+](=O)[O-])c(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.41
▸ MEN1 O00255 6/20 0.41
▸ DCTPP1 Q9H773 4/20 0.39
▸ POLB P06746 2/20 0.39
▸ MAPT P10636 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HTT P42858 2/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ HKDC1 Q2TB90 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ AGTR1 P30556 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
SCHEMBL6491706 1.00 KMT2A (0.41) KMT2AMEN1DCTPP1POLBMAPT
SCHEMBL6505656 0.89 DCTPP1 (0.42) KMT2AMEN1DCTPP1POLBMAPT
SCHEMBL6298966 0.86 KMT2A (0.51) KMT2AMEN1DCTPP1POLBMAPT
SCHEMBL6491865 0.84 PTGS2 (0.43) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL6299298 0.83 SMN1; SMN2 (0.40) KMT2APOLBMAPTSMN1; SMN2ALDH1A1
SCHEMBL6505142 0.81 ALDH1A1 (0.39) KMT2AMEN1DCTPP1MAPTSMN1; SMN2
SCHEMBL6491775 0.81 PPARG (0.54) MAPTLMNA
SCHEMBL6299335 0.81 PPARG (0.47) MAPTSMN1; SMN2ALDH1A1NPSR1NPC1
SCHEMBL6299786 0.81 ALDH1A1 (0.43) KMT2AMEN1DCTPP1MAPTSMN1; SMN2
SCHEMBL7839471 0.80 ALDH1A1 (0.42) KMT2AMEN1DCTPP1MAPTSMN1; SMN2

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-1136492-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF AS MEDICINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-26 — — EP disclosed
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