SCHEMBL11759876

SCHEMBL11759876

Cc1cccc(NC(=O)c2cc(C(C)(C)C)ccc2S)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 4/20 0.59
▸ MEN1 O00255 6/20 0.55
▸ KMT2A Q03164 6/20 0.55
▸ NR1H4 Q96RI1 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.53
▸ TP53 P04637 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ THRB P10828 1/20 0.53
▸ RAB9A P51151 2/20 0.52
▸ HTT P42858 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.51
▸ HDAC3 O15379 1/20 0.51
▸ HDAC8 Q9BY41 1/20 0.51
▸ HDAC6 Q9UBN7 1/20 0.51
▸ KCNK9 Q9NPC2 4/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ P2RX1 P51575 1/20 0.49
▸ SORT1 Q99523 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ NFKB1 P19838 1/20 0.48

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
SCHEMBL11758289 0.88 MEN1 (0.49) KCNK3MEN1KMT2ANR1H4ALDH1A1
SCHEMBL11762767 0.87 MEN1 (0.49) KCNK3MEN1KMT2ANR1H4ALDH1A1
SCHEMBL11761059 0.86 MEN1 (0.61) KCNK3MEN1KMT2AALDH1A1TP53
SCHEMBL20022687 0.80 MEN1 (0.70) KCNK3MEN1KMT2AALDH1A1RAB9A
SCHEMBL7293743 0.80 KCNK3 (0.86) KCNK3MEN1KMT2ANR1H4ALDH1A1
SCHEMBL20064059 0.78 KCNK3 (0.77) KCNK3MEN1KMT2ANR1H4THRB
SCHEMBL11764243 0.76 PLG (0.58) NR1H4ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL12764066 0.76 KCNK3 (0.70) KCNK3MEN1KMT2AALDH1A1TP53
SCHEMBL15603529 0.75 KCNK3 (0.82) KCNK3MEN1KMT2ATP53RAB9A
SCHEMBL7292373 0.75 NR1H4 (0.55) KCNK3NR1H4TP53SMN1; SMN2THRB

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
US-4008274-A ANTIFOULING YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JA) 1977-02-15 — — US disclosed
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