SCHEMBL6931448

SCHEMBL6931448

CC(N)OC(=O)c1ccccc1C(=O)OC(C)N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.52
▸ TSHR P16473 6/20 0.52
▸ HSD17B10 Q99714 3/20 0.48
▸ CFTR P13569 1/20 0.48
▸ NPC1 O15118 1/20 0.46
▸ IRAK4 Q9NWZ3 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ PDCD1 Q15116 1/20 0.40
▸ CD274 Q9NZQ7 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ SCN1A P35498 1/20 0.40
▸ SCN2A Q99250 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
SCHEMBL28281250 0.88 SMN1; SMN2 (0.50) ALDH1A1TSHRHSD17B10CFTRNPC1
SCHEMBL5195832 0.88 LMNA (0.58) ALDH1A1TSHRHSD17B10CFTRKMT2A
SCHEMBL27639515 0.85 KMT2A (0.51) ALDH1A1TSHRHSD17B10CFTRNPC1
SCHEMBL27920663 0.83 ALDH1A1 (0.56) ALDH1A1HSD17B10NPC1KMT2ATDP1
SCHEMBL6295908 0.83 ALDH1A1 (0.48) ALDH1A1TSHRHSD17B10CFTRNPC1
SCHEMBL1171200 0.83 TSHR (0.52) ALDH1A1TSHRHSD17B10CFTRNPC1
SCHEMBL29895757 0.83 TSHR (0.52) ALDH1A1TSHRHSD17B10CFTRNPC1
SCHEMBL4380299 0.82 HSD17B10 (0.59) ALDH1A1TSHRHSD17B10NPC1IRAK4
SCHEMBL137907 0.82 NPC1 (0.62) ALDH1A1TSHRHSD17B10NPC1IRAK4
SCHEMBL28983281 0.81 HCRTR1 (0.53) ALDH1A1TSHRHSD17B10KMT2AL3MBTL1

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-6525908-B1 Floppy disk FUJI PHOTO FILM CO., LTD. (JP) 2003-02-25 — — US disclosed
US-4253886-A Corrosion resistant ferromagnetic metal powders and method of preparing the same FUJI PHOTO FILM CO., LTD. (JP) 1981-03-03 — — US disclosed
Send feedback