SCHEMBL28307152

SCHEMBL28307152

CC(C)c1csc(-c2ccccc2C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
TSHR P16473 1/20 0.42
MYC P01106 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
NOTUM Q6P988 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALOX15 P16050 1/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
DHODH Q02127 1/20 0.38
FOLH1 Q04609 1/20 0.38
UCHL5 Q9Y5K5 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL28913097 0.76 NPC1 (0.51) ALDH1A1KDM4EUSP2TSHRMYC
SCHEMBL13301395 0.73 AR (0.40) MAPTLMNACYP3A4CYP2C9
SCHEMBL4741406 0.72 DHODH (0.56) USP2MYCNPC1RAB9ASMN1; SMN2
SCHEMBL5151189 0.72 RXRA (0.58) ALDH1A1MYCSMN1; SMN2L3MBTL1NOTUM
Hydrochloric Acid SCHEMBL5937171 0.71 DHODH (0.55) USP2MYCNPC1RAB9ASMN1; SMN2
SCHEMBL14693653 0.69 MYC (0.47) ALDH1A1KDM4EUSP2TSHRMYC
SCHEMBL932848 0.68 ALOX15 (0.53) ALDH1A1KDM4EMYCNPC1RAB9A
SCHEMBL4600188 0.68 MYC (0.50) ALDH1A1KDM4EUSP2TSHRMYC
SCHEMBL20173747 0.68 RXRA (0.49) TSHRNOTUMMEN1KMT2AMAPT
SCHEMBL36145 0.68 ALDH1A1 (0.72) ALDH1A1KDM4EMYCSMN1; SMN2L3MBTL1

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-109928951-A The preparation method of 2- isopropyl thioxanthone 山东久日化学科技有限公司 2019-06-25 CN claimed
CN-216727224-U Reflux liquid-separating reaction device for mutually soluble components 山东久日化学科技有限公司 2022-06-14 CN disclosed
CN-109928951-B Preparation method of 2-isopropyl thioxanthone 山东久日化学科技有限公司 2022-03-08 CN disclosed
CN-109928951-A The preparation method of 2- isopropyl thioxanthone 山东久日化学科技有限公司 2019-06-25 CN disclosed
CN-109928951-A The preparation method of 2- isopropyl thioxanthone 山东久日化学科技有限公司 2019-06-25 CN disclosed