SCHEMBL11295149

SCHEMBL11295149

Cc1ccc(SCc2ccccc2Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.51
▸ GAA P10253 2/20 0.47
▸ MGAM O43451 1/20 0.47
▸ SI P14410 1/20 0.47
▸ MGAM2 Q2M2H8 1/20 0.47
▸ DAO P14920 1/20 0.47
▸ MAPT P10636 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ HPGD P15428 2/20 0.44

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
SCHEMBL29304015 0.78 KMT2A (0.53) KMT2AGAADAOMAPTHTT
SCHEMBL4612860 0.78 KMT2A (0.51) KMT2AGAAMGAMSIMGAM2
SCHEMBL28497830 0.78 GAA (0.54) KMT2AGAAMGAMSIMGAM2
SCHEMBL28502919 0.78 NPC1 (0.55) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL28386938 0.76 KMT2A (0.50) KMT2AGAAMGAMSIMGAM2
SCHEMBL28505527 0.75 CYP1A2 (0.56) MAPTHTTLMNACYP1A2CYP2D6
SCHEMBL28543149 0.75 HPGD (0.58) KMT2AGAAMAPTLMNAMAPK1
SCHEMBL1815738 0.75 KMT2A (0.58) KMT2AGAADAOMAPTHTT
SCHEMBL5803048 0.75 HPGD (0.46) KMT2AMAPTHTTLMNACYP1A2
SCHEMBL21338153 0.74 HPGD (0.71) KMT2AGAAMGAMSIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112521240-B Synthesis method of asymmetric thioether 扬州大学 2023-06-30 — — CN disclosed
CN-112521240-A Method for synthesizing asymmetric thioether 扬州大学 2021-03-19 — — CN disclosed
CN-106008298-A Green method for preparing asymmetric thioether from alcohol and mercaptan 温州大学 2016-10-12 — — CN disclosed
CN-104557957-A Synthetic method of spiro-oxoindole ethylene oxide derivative UNIV EAST CHINA NORMAL 2015-04-29 — — CN disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 — — US disclosed
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