SCHEMBL9575839

SCHEMBL9575839

OC(c1ccccc1)c1ccccc1S

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
CYP2C9 P11712 1/20 0.50
KMT2A Q03164 1/20 0.50
ADORA2A P29274 2/20 0.42
ADORA1 P30542 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 3/20 0.39
MAPK1 P28482 1/20 0.39
DRD2 P14416 1/20 0.39
DRD1 P21728 1/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 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
SCHEMBL7809671 0.85 MEN1 (0.63) MEN1MAPTCYP2C9KMT2AADORA2A
SCHEMBL9193862 0.78 MEN1 (0.52) MEN1MAPTCYP2C9KMT2AADORA2A
SCHEMBL6578256 0.76 MEN1 (0.50) MEN1MAPTCYP2C9KMT2AADORA2A
SCHEMBL29405346 0.76 MAPT (0.50) MEN1MAPTCYP2C9KMT2ASMN1; SMN2
SCHEMBL984999 0.76 MAPT (0.50) MEN1MAPTCYP2C9KMT2ASMN1; SMN2
Diphenylmethanol SCHEMBL41571 0.76 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1LMNAMAPK1TSHR
Diphenylmethanol SCHEMBL11564700 0.76 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1LMNAMAPK1TSHR
Diphenylmethanol SCHEMBL10868602 0.76 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1LMNAMAPK1TSHR
Diphenylmethanol SCHEMBL6434457 0.76 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1LMNAMAPK1TSHR
SCHEMBL21380575 0.75 SLC6A2 (0.42) MAPTKMT2AL3MBTL1GAATSHR

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-117117191-A Positive electrode lithium supplementing material, preparation method thereof, positive electrode plate and secondary battery 深圳市德方创域新能源科技有限公司 2023-11-24 CN disclosed
EP-0367671-B1 NOVEL BETA-D-PHENYLTHIOXYLOSIDES, THEIR METHOD OF PREPARATION AND THEIR USE AS PHARMACEUTICALS FOURNIER INDUSTRIE ET SANTE (FR) 1993-07-28 EP disclosed