SCHEMBL30135339

SCHEMBL30135339

O=C(OC(=O)[C@H]1CCCO1)[C@H]1CCCO1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.46
HPGD P15428 8/20 0.45
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ALDH1A1 P00352 7/20 0.42
POLB P06746 4/20 0.42
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
RECQL P46063 1/20 0.39
TP53 P04637 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL30135380 1.00 NOS2 (0.46) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL9328453 1.00 NOS2 (0.46) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL5046503 0.93 HPGD (0.44) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL31343355 0.91 HPGD (0.43) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL8009356 0.87 HPGD (0.34) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL116749 0.87 HPGD (0.44) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL14984838 0.84
SCHEMBL20599743 0.82 RECQL (0.45) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL1436618 0.82 HPGD (0.38) NOS2HPGDTSHRNPSR1ALDH1A1
SCHEMBL6444441 0.82

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
CN-117642410-A Ester derivatives of N4-hydroxycytidine and uses thereof 苏州春海生物医药有限公司 2024-03-01 CN disclosed
WO-2022262845-A1 ESTER DERIVATIVES OF N4-HYDROXYCYTIDINE AND USE THEREOF SUZHOU SPRING-SEA BIO-PHARMACEUTICALS CO., LTD. (CN) 2022-12-22 WO disclosed