SCHEMBL28376345

SCHEMBL28376345

O=C(O)c1ccccc1N=S

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ IDE P14735 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.48
▸ CA12 O43570 1/20 0.48
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ HMGB1 P09429 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ CA4 P22748 1/20 0.48
▸ CA6 P23280 1/20 0.48
▸ CA7 P43166 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ CA9 Q16790 1/20 0.48
▸ NAPRT Q6XQN6 1/20 0.48
▸ CA14 Q9ULX7 1/20 0.48
▸ MAPT P10636 3/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ MYC P01106 1/20 0.46
▸ POLB P06746 2/20 0.45

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
SCHEMBL28170457 0.98 ALDH1A1 (0.54) ALDH1A1ALOX15IDEKDM4ECA12
SCHEMBL27939420 0.98 ALDH1A1 (0.54) ALDH1A1ALOX15IDEKDM4ECA12
Ammonia Solution, Strong SCHEMBL28848974 0.98 ALDH1A1 (0.54) ALDH1A1ALOX15IDEKDM4ECA12
Pyrrole SCHEMBL28255637 0.89 ALDH1A1 (0.45) ALDH1A1ALOX15IDEKDM4ECA12
SCHEMBL29154515 0.84 CYP3A4 (0.49) ALDH1A1ALOX15IDEKDM4ECA12
SCHEMBL68504 0.81 IDE (0.71) ALDH1A1ALOX15IDEKDM4ECA12
SCHEMBL68503 0.81 IDE (0.71) ALDH1A1ALOX15IDEKDM4ECA12
SCHEMBL840296 0.80 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL3056257 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15IDEKDM4ECA12
SCHEMBL1081928 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15IDEKDM4ECA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110818726-B Hole transport material, preparation method thereof and electroluminescent device 武汉华星光电半导体显示技术有限公司 2021-04-02 — — CN disclosed
CN-112062699-B Preparation method of o-aminothiophenol 苏州开元民生科技股份有限公司 2021-02-26 — — CN disclosed
CN-112062699-A Preparation method of o-aminothiophenol 苏州开元民生科技股份有限公司 2020-12-11 — — CN disclosed
CN-110818726-A Hole transport material, preparation method thereof and electroluminescent device 武汉华星光电半导体显示技术有限公司 2020-02-21 — — CN disclosed
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