SCHEMBL30396376

SCHEMBL30396376

O=C1c2ccccc2C(=O)C1Cc1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CASP6 P55212 1/20 0.47
GLA P06280 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 5/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
DAO P14920 3/20 0.45
PNMT P11086 1/20 0.44
HSD17B2 P37059 1/20 0.44
KDM4E B2RXH2 2/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
C3AR1 Q16581 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK1 P28482 1/20 0.42
GAA P10253 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42

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
SCHEMBL29007581 1.00 MEN1 (0.47) MEN1KMT2ACASP6GLASMN1; SMN2
SCHEMBL27601548 0.82 MEN1 (0.44) MEN1KMT2ACASP6GLASMN1; SMN2
SCHEMBL27897690 0.81 PNMT (0.46) MEN1KMT2ACASP6GLASMN1; SMN2
SCHEMBL29007602 0.80 RAB9A (0.53) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL30396872 0.79 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL9055148 0.79 MAPT (0.52) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL29007598 0.76 NR1H2 (0.50) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL2673228 0.75 SMN1; SMN2 (0.46) MEN1KMT2AGLASMN1; SMN2MAPT
SCHEMBL28010769 0.72 GSK3B (0.59) MAPTKDM4EHTTGAA
SCHEMBL30429056 0.72 HSD17B2 (0.41) MEN1KMT2ACASP6GLASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112209907-B Method for synthesizing dihydrofuran containing 1, 3-indenodione spiro framework by utilizing microchannel reaction device 南京先进生物材料与过程装备研究院有限公司 2025-03-18 CN disclosed
CN-116162076-B Spirocyclic gamma-butyrolactone containing carboxylic acid tert-butyl ester and 1, 3-indene diketone structure and preparation method thereof 南京工业大学 2024-03-29 CN disclosed
CN-116162076-A Spirocyclic gamma-butyrolactone containing carboxylic acid tert-butyl ester and 1, 3-indene diketone structure and preparation method thereof 南京工业大学 2023-05-26 CN disclosed