SCHEMBL28601258

SCHEMBL28601258

O=C(O)c1cc(O)c(-n2nc3ccccc3n2)c(C(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.39
HPGD P15428 3/20 0.39
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA4 P22748 3/20 0.39
CA6 P23280 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TP53 P04637 1/20 0.39
CA3 P07451 1/20 0.39
SELL P14151 1/20 0.39
SELP P16109 1/20 0.39
FUT4 P22083 1/20 0.39

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
SCHEMBL9868485 0.79 NPC1 (0.46) KDM4EHPGDLMNASMN1; SMN2ALDH1A1
SCHEMBL9755840 0.75 NPC1 (0.42) KDM4EHPGDCA12CA1CA2
SCHEMBL2797053 0.72 NPC1 (0.59) KDM4EHPGDCA12CA1CA2
SCHEMBL31309385 0.72 NPC1 (0.59) KDM4EHPGDCA12CA1CA2
SCHEMBL17296033 0.72 NPC1 (0.51) KDM4EHPGDCA12CA1CA2
SCHEMBL2474061 0.71 RAB9A (0.49) KDM4EHPGDLMNASMN1; SMN2ALDH1A1
SCHEMBL2802927 0.71 NPC1 (0.49) KDM4EHPGDLMNASMN1; SMN2ALDH1A1
SCHEMBL14255449 0.71 MEN1 (0.46) KDM4EHPGDLMNASMN1; SMN2ALDH1A1
Salicylic Acid SCHEMBL20923488 0.69 ALDH1A1 (0.58) KDM4EHPGDCA12CA1CA2
SCHEMBL673476 0.69 NPC1 (0.38) KDM4EHPGDCA12CA1CA2

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
CN-109825057-B Modified PET/PC alloy with high anti-reflection and good ultraviolet resistance and preparation method thereof 广州仕天材料科技有限公司 2021-08-06 CN claimed