SCHEMBL10925899

SCHEMBL10925899

O=C(c1ccc(Cl)cc1)c1cc(CSc2ccccc2)on1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.61
KMT2A Q03164 5/20 0.61
L3MBTL1 Q9Y468 4/20 0.61
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
TDP1 Q9NUW8 4/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
LMNA P02545 2/20 0.50
ALPG P10696 1/20 0.49
MAPT P10636 3/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
PKM P14618 1/20 0.43
USP2 O75604 1/20 0.41
CNR2 P34972 1/20 0.41
DAO P14920 2/20 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
SCHEMBL5458534 0.82 MEN1 (0.60) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL10926478 0.81 MAPT (0.49) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL10925695 0.76 GSK3B (0.43) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL5451531 0.76 MEN1 (0.56) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL5460248 0.76 L3MBTL1 (0.61) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL10925137 0.76 SMN1; SMN2 (0.42) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL10925299 0.76 NPC1 (0.48) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL10925827 0.75 SMN1; SMN2 (0.43) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL10925903 0.73 KMT2A (0.41) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL3220418 0.73 ALDH1A1 (0.57) MEN1KMT2AL3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4562187-A HYPOTENSIVE AGENTS, ANTIINFLAMMATORY, AGENTS, AND ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-12-31 US claimed
EP-0189771-A3 (ISOXAZOL-3-YL)ARYLMETHANONES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-10-08 EP disclosed
EP-0189771-A2 (Isoxazol-3-yl)arylmethanones, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-08-06 EP disclosed
US-4562187-A HYPOTENSIVE AGENTS, ANTIINFLAMMATORY, AGENTS, AND ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-12-31 US disclosed