SCHEMBL11758305

SCHEMBL11758305

CCC(C)(C)c1ccc(O)c(C(=O)Nc2cccc(SC)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 1/20 0.54
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ NPC1 O15118 4/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MAPT P10636 2/20 0.50
▸ PLG P00747 2/20 0.49
▸ KLK1 P06870 2/20 0.49
▸ KLK6 Q92876 2/20 0.49
▸ KLKB1 P03952 1/20 0.49
▸ P2RX1 P51575 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ GRM4 Q14833 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL11762775 0.90 NR1H4 (0.53) NR1H4MEN1KMT2ANPC1SMN1; SMN2
SCHEMBL11759885 0.88 NR1H4 (0.65) NR1H4MEN1KMT2ANPC1SMN1; SMN2
SCHEMBL11761072 0.79 MAPT (0.61) MEN1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL11758452 0.74 NPC1 (0.62) MEN1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL12368181 0.74 MAPT (0.61) MEN1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL11763911 0.74 MAPT (0.58) MEN1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL27181188 0.73 SMN1; SMN2 (0.74) NR1H4MEN1KMT2ANPC1SMN1; SMN2
SCHEMBL30926970 0.73 SMN1; SMN2 (0.74) NR1H4MEN1KMT2ANPC1SMN1; SMN2
SCHEMBL13898693 0.73 HSP90AA1 (0.50) MEN1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL11765556 0.73 KMT2A (0.54) MEN1KMT2ANPC1RAB9ALMNA

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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