SCHEMBL9142854

SCHEMBL9142854

COC(=O)c1ccc(C(=O)NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)cn1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ P4HTM Q9NXG6 8/20 0.60
▸ KDM4E B2RXH2 1/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ PTPN1 P18031 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ PRMT1 Q99873 1/20 0.49

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
SCHEMBL9139748 0.92 NPC1 (0.58) P4HTMKDM4ENPC1ALDH1A1RAB9A
SCHEMBL8869543 0.89 P4HTM (0.76) P4HTMKDM4E
SCHEMBL9139742 0.88 P4HTM (0.54) P4HTMKDM4ENPC1ALDH1A1RAB9A
SCHEMBL9139720 0.88 P4HTM (0.58) P4HTMKDM4EALDH1A1LMNAHSD17B10
SCHEMBL9143209 0.87 RAB9A (0.57) P4HTMNPC1ALDH1A1RAB9ALMNA
SCHEMBL9140161 0.86 ALDH1A1 (0.59) P4HTMKDM4EALDH1A1LMNAHSD17B10
SCHEMBL8869178 0.86 P4HTM (0.54) P4HTMKDM4ENPC1ALDH1A1RAB9A
SCHEMBL9284622 0.85 L3MBTL1 (0.60) P4HTMALDH1A1LMNATDP1MEN1
SCHEMBL9137568 0.85 P4HTM (0.55) P4HTMALDH1A1HSD17B10SMN1; SMN2
SCHEMBL9140706 0.84 P4HTM (0.64) P4HTM

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-5428046-A Antifibrotic agents HOECHST AKTIENGESELLSCHAFT (DE) 1995-06-27 — — US disclosed
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