SCHEMBL28201855

SCHEMBL28201855

O=C(Cl)c1ccc(-c2ccc(F)cc2)o1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.59
PTPN1 P18031 1/20 0.55
ALDH1A1 P00352 6/20 0.54
KDM4E B2RXH2 4/20 0.54
LMNA P02545 3/20 0.54
HPGD P15428 3/20 0.54
PDE4B Q07343 5/20 0.52
PDE4D Q08499 3/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 1/20 0.49
MGAM O43451 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
SI P14410 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MGAM2 Q2M2H8 1/20 0.49
RPA1 P27694 1/20 0.47
HSD17B1 P14061 1/20 0.47

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
SCHEMBL3325905 0.83 ALDH1A1 (0.61) SLC9A1PTPN1ALDH1A1KDM4ELMNA
SCHEMBL3054179 0.83 ALDH1A1 (0.70) SLC9A1PTPN1ALDH1A1KDM4ELMNA
SCHEMBL13078607 0.81 SLC9A1 (0.59) SLC9A1PTPN1ALDH1A1KDM4ELMNA
SCHEMBL15218337 0.81 ALDH1A1 (0.69) SLC9A1PTPN1ALDH1A1KDM4ELMNA
SCHEMBL9477105 0.81 ALDH1A1 (0.69) ALDH1A1KDM4ELMNAHPGDPDE4B
SCHEMBL28511353 0.81 PDE4B (0.52) ALDH1A1KDM4ELMNAHPGDPDE4B
SCHEMBL221022 0.81 ALDH1A1 (0.67) SLC9A1PTPN1ALDH1A1KDM4ELMNA
SCHEMBL8864088 0.81 SLC9A1 (0.55) SLC9A1PTPN1ALDH1A1KDM4ELMNA
SCHEMBL28202414 0.80 ALDH1A1 (0.49) SLC9A1PTPN1ALDH1A1KDM4ELMNA
SCHEMBL29353751 0.80 NR4A1 (0.74) SLC9A1PDE4BMGAMGAASI

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116535371-B Guanidine-containing phenyl furan carboxamide compound and application thereof 华南农业大学 2025-02-18 CN disclosed
CN-116535371-A Guanidine-containing phenyl furan carboxamide compound and application thereof 华南农业大学 2023-08-04 CN disclosed
CN-110294749-B (S) -1, 3-thiazole phenyl furan thiocarbamate compound and preparation method and application thereof 华南农业大学 2022-01-25 CN disclosed
CN-109265452-B Substituted phenyl furan-2-mercaptothiazoline ketone compounds and preparation method and application thereof 华南农业大学 2021-08-03 CN disclosed
CN-110183428-B Furan thiocarbamate compound containing 1,2,3, 4-tetrazole and preparation method and application thereof 华南农业大学 2021-08-03 CN disclosed
CN-107674070-B Cyanoimine thiazolidine furan carboxamide compound and preparation method and application thereof 华南农业大学 2020-12-29 CN disclosed
CN-107674070-A A kind of cyano group imines thiazolidine furoyl amine compound and its preparation method and application 华南农业大学 2018-02-09 CN disclosed