SCHEMBL11235876

SCHEMBL11235876

Cc1cc2occ(NC(=O)C3C(=O)c4ccccc4S(=O)(=O)N3C)c(=O)c2cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.48
▸ PTPN1 P18031 1/20 0.38
▸ TOP2A P11388 3/20 0.36
▸ MAOB P27338 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ KCNA3 P22001 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ USP2 O75604 2/20 0.33
▸ KDR P35968 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL11234155 0.93 ALDH1A1 (0.52) ALDH1A1MAOBMEN1KMT2ALMNA
SCHEMBL11238856 0.86 ALDH1A1 (0.51) ALDH1A1MAOBMEN1KMT2AUSP2
SCHEMBL11227836 0.85 ALDH1A1 (0.53) ALDH1A1MAOB
SCHEMBL11240239 0.84 ALDH1A1 (0.48) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL11227476 0.84 ALDH1A1 (0.46) ALDH1A1MAOBMEN1KMT2ALMNA
SCHEMBL11238000 0.82 ALDH1A1 (0.46) ALDH1A1MAOBKMT2ALMNAL3MBTL1
SCHEMBL11232506 0.82 ALDH1A1 (0.50) ALDH1A1MAOBMEN1KMT2ALMNA
SCHEMBL11245007 0.81 ALDH1A1 (0.52) ALDH1A1MAOBMEN1KMT2ALMNA
SCHEMBL11234091 0.76 LMNA (0.40) ALDH1A1PTPN1TOP2AMAOBLMNA
SCHEMBL11224073 0.74 MAOB (0.43) ALDH1A1MAOB

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
US-4327091-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1982-04-27 — — US disclosed
US-4213980-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1980-07-22 — — US disclosed
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