SCHEMBL24797595

SCHEMBL24797595

CNC(CC(N)=O)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 7/20 0.51
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ F2 P00734 1/20 0.40
▸ PLG P00747 1/20 0.40
▸ PLAU P00749 1/20 0.40
▸ PLAT P00750 1/20 0.40
▸ KLKB1 P03952 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ ROCK1 Q13464 1/20 0.39
▸ MYLK4 Q86YV6 1/20 0.39
▸ SPHK2 Q9NRA0 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CIT O14578 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ SLC1A3 P43003 1/20 0.37
▸ SLC1A2 P43004 1/20 0.37
▸ SLC1A1 P43005 1/20 0.37
▸ CRHBP P24387 1/20 0.37

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
SCHEMBL17300179 0.82 HSD17B10 (0.49) SPHK1CA1CA2F2PLG
SCHEMBL19375764 0.80 SPHK1 (0.49) SPHK1CA1CA2F2PLG
SCHEMBL16784039 0.80 SPHK1 (0.46) SPHK1CA1CA2ROCK1MYLK4
SCHEMBL24475446 0.80 SPHK1 (0.49) SPHK1F2PLGPLAUPLAT
SCHEMBL27431579 0.80 SPHK1 (0.49) SPHK1F2PLGPLAUPLAT
SCHEMBL20356318 0.79 TAAR1 (0.43) SPHK1CA1CA2TAAR1SMN1; SMN2
SCHEMBL19019941 0.79 MMP3 (0.42) SPHK1CA1CA2SMN1; SMN2
SCHEMBL22001798 0.79 TAAR1 (0.43) SPHK1CA1CA2TAAR1SMN1; SMN2
SCHEMBL17615149 0.79 TAAR1 (0.43) SPHK1CA1CA2TAAR1SMN1; SMN2
SCHEMBL19318327 0.79 TAAR1 (0.43) SPHK1CA1CA2TAAR1SMN1; SMN2

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
EP-4108675-A1 PREPARATION AND USE OF IMMUNOSTIMULATORY COUPLING COMPLEX WHICH IS DELIVERED AND ACTIVATED IN TARGETED MANNER Yafei Shanghai Biolog Medicine Science & Technology Co., Ltd. (CN) 2022-12-28 — — EP disclosed
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