SCHEMBL30786194

SCHEMBL30786194

COC(=O)c1c(F)cccc1SCc1ccc(OC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 4/20 0.44
LMNA P02545 2/20 0.43
HDAC3 O15379 1/20 0.43
NCOR1 O75376 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
TP53 P04637 1/20 0.43
RAB9A P51151 3/20 0.42
HPGD P15428 2/20 0.42
MAOB P27338 1/20 0.42
ABL1 P00519 1/20 0.41
SRC P12931 1/20 0.41
FFAR1 O14842 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL17080275 1.00 MEN1 (0.44) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL30786161 0.88 FFAR1 (0.47) MEN1KMT2AALDH1A1MAPTHDAC3
SCHEMBL29070098 0.81 TP53 (0.40) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL30786136 0.80 KDM4E (0.46) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL17080240 0.80 KDM4E (0.46) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL28326285 0.79 POLB (0.58) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL24928854 0.75 ALDH1A1 (0.46) KMT2AALDH1A1MAPTLMNAHDAC3
SCHEMBL30845570 0.75 ALDH1A1 (0.46) KMT2AALDH1A1MAPTLMNAHDAC3
SCHEMBL10741537 0.75 TAAR1 (0.50) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL2014297 0.74 L3MBTL1 (0.58) MEN1KMT2AALDH1A1MAPTLMNA

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
WO-2025082316-A1 OPHTHALMIC FORMATION, AND PREPARATION METHOD THEREFOR AND USE THEREOF 苏州必扬医药科技有限公司 2025-04-24 WO disclosed
WO-2024032584-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF 苏州必扬医药科技有限公司 2024-02-15 WO disclosed