SCHEMBL28615722

SCHEMBL28615722

Cc1cccc(Oc2cccc(C)c2NSc2ccccc2)c1NSc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ SGMS2 Q8NHU3 1/20 0.35
▸ KMT2A Q03164 3/20 0.34
▸ TSHR P16473 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ATM Q13315 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31

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
SCHEMBL24287425 0.68 ALDH1A1 (0.40) CYP1A2CYP2C19KMT2ATSHRSMN1; SMN2
SCHEMBL29637724 0.65 TSHR (0.65) CYP1A2CYP2C19KMT2ATSHRSMN1; SMN2
SCHEMBL127000 0.65 TSHR (0.65) CYP1A2CYP2C19KMT2ATSHRSMN1; SMN2
SCHEMBL16682061 0.64 L3MBTL1 (0.45) KMT2ATSHRSMN1; SMN2MEN1NPC1
SCHEMBL31448448 0.63 ALDH1A1 (0.43) CYP1A2CYP3A4KMT2ATSHRSMN1; SMN2
Phosphine SCHEMBL22634020 0.63 TSHR (0.62) CYP1A2CYP2C19KMT2ATSHRSMN1; SMN2
Fluoride SCHEMBL27757467 0.63 TSHR (0.62) CYP1A2CYP2C19KMT2ATSHRSMN1; SMN2
Biphenyl SCHEMBL7781908 0.62 SMN1; SMN2 (0.56) CYP1A2CYP2C19KMT2ATSHRSMN1; SMN2
SCHEMBL29185416 0.62 TSHR (0.56) CYP1A2CYP2C19KMT2ATSHRSMN1; SMN2
SCHEMBL19234396 0.62 HPGD (0.52) KMT2ATSHRSMN1; SMN2MEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110191915-B Prepreg, method for producing same, and slit tape prepreg 东丽株式会社 2021-07-23 — — CN disclosed
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