SCHEMBL27310284

SCHEMBL27310284

CCN(CC)c1ccc2cc(C(=O)NC[C@H](N)C(=O)O)c(=O)oc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.65
▸ HPGD P15428 4/20 0.65
▸ KDM4E B2RXH2 4/20 0.65
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ HSD17B10 Q99714 2/20 0.65
▸ SLC16A3 O15427 1/20 0.65
▸ ALOX15 P16050 1/20 0.65
▸ SLC16A1 P53985 1/20 0.65
▸ KMT2A Q03164 9/20 0.64
▸ MEN1 O00255 8/20 0.64
▸ MAPT P10636 7/20 0.64
▸ ATM Q13315 4/20 0.64
▸ MAOB P27338 4/20 0.61
▸ USP2 O75604 2/20 0.61
▸ CYP1A2 P05177 1/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ GBA1 P04062 1/20 0.59
▸ NPC1 O15118 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ STAT3 P40763 1/20 0.56

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
SCHEMBL18618658 0.92 KMT2A (0.65) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL27309210 0.88 KMT2A (0.59) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL13521824 0.88 ALDH1A1 (0.60) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL16293207 0.84 KMT2A (0.73) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL13081989 0.84 KMT2A (0.70) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL13403918 0.83 KMT2A (0.71) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL29611843 0.83 MEN1 (0.77) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL580009 0.83 MEN1 (0.77) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL15179178 0.82 KMT2A (0.64) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10
SCHEMBL19686997 0.82 KMT2A (0.64) ALDH1A1HPGDKDM4ESMN1; SMN2HSD17B10

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
WO-2024073568-A2 EVOLUTION OF FLUOROGENIC SENSORS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2024-04-04 — — WO disclosed
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