SCHEMBL23748938

SCHEMBL23748938

O=C(Oc1cncs1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
F2 P00734 1/20 0.44
KMT2A Q03164 6/20 0.43
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 3/20 0.41
MEN1 O00255 3/20 0.41
PARP10 Q53GL7 1/20 0.41
ALDH1A1 P00352 4/20 0.40
PKM P14618 2/20 0.40
HPGD P15428 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NLRP1 Q9C000 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
SLC6A3 Q01959 1/20 0.39
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
JAK2 O60674 1/20 0.38

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
SCHEMBL185066 0.77
SCHEMBL27816961 0.73 L3MBTL1 (0.45) LMNAF2KMT2AMAPTSMN1; SMN2
SCHEMBL732742 0.73 MMP1 (0.53) LMNAF2KMT2AMAPTSMN1; SMN2
SCHEMBL5229371 0.72
SCHEMBL7802262 0.70 F2 (0.45) LMNAF2KMT2AMAPTSMN1; SMN2
SCHEMBL27736514 0.70 KMT2A (0.48) LMNAF2KMT2AMAPTSMN1; SMN2
SCHEMBL25220465 0.69 KMT2A (0.53) LMNAF2KMT2AMAPTTDP1
SCHEMBL29154627 0.69 MEN1 (0.58) KMT2AMAPTTDP1MEN1
SCHEMBL175110 0.69 HPGDS (0.53) LMNAKMT2AMAPTSMN1; SMN2TDP1
SCHEMBL5551848 0.68 LMNA (0.64) LMNAF2KMT2AMAPTSMN1; SMN2

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
EP-3863711-A1 AMINO ACID COMPOUNDS AND METHODS OF USE Pliant Therapeutics, Inc. (US) 2021-08-18 EP disclosed