SCHEMBL25868195

SCHEMBL25868195

O=S(=O)(CC1CCC(c2ccc(F)cc2)=N1)N1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ ALDH1A1 P00352 5/20 0.37
▸ MAPT P10636 4/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ FKBP1A P62942 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ USP2 O75604 1/20 0.35

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
SCHEMBL25868627 0.87 PKM (0.43) LMNATSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL25868201 0.87 TSHR (0.43) LMNATSHRNPSR1ALDH1A1MAPT
SCHEMBL25868198 0.86 LMNA (0.45) LMNATSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL25868194 0.77 LMNA (0.41) LMNATSHRALDH1A1MAPTKMT2A
SCHEMBL25871670 0.71 TSHR (0.35) TSHRALDH1A1MAPTKDM4EHPGD
SCHEMBL25868529 0.71 TSHR (0.35) TSHRALDH1A1MAPTKDM4EHPGD
SCHEMBL25868015 0.71 TSHR (0.35) TSHRALDH1A1MAPTKDM4EHPGD
SCHEMBL25868125 0.64 HPGD (0.34) LMNAALDH1A1MAPTKMT2AKDM4E
SCHEMBL22039704 0.63 NOS3 (0.38) TSHRALDH1A1MAPTCYP3A4CYP2C19
SCHEMBL22040850 0.63 NOS3 (0.38) TSHRALDH1A1MAPTCYP3A4CYP2C19

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-2023134691-A1 HIGH-VOLTAGE ELECTROLYTE AND BATTERY CONTAINING ELECTROLYTE 珠海冠宇电池股份有限公司 2023-07-20 — — WO disclosed
Send feedback