SCHEMBL23388792

SCHEMBL23388792

O=C(O)c1cc2csc(Br)c2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 7/20 0.47
BCL2L1 Q07817 1/20 0.42
TSHR P16473 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GLA P06280 1/20 0.40
PKM P14618 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALAD P13716 1/20 0.39
DAO P14920 5/20 0.38
PTPN2 P17706 2/20 0.38
MAPT P10636 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 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
SCHEMBL23424463 0.84 CES2 (0.34) TSHRALDH1A1PTPN2HDAC3HDAC4
SCHEMBL24928227 0.84 PTPN2 (0.39) TSHRALDH1A1KDM4EMEN1KMT2A
SCHEMBL24928206 0.83 HPGD (0.44) TSHRALDH1A1KDM4EMEN1KMT2A
SCHEMBL18434899 0.80 CES2 (0.35) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL23317050 0.76 STING1 (0.33) ALDH1A1
SCHEMBL6811699 0.72 GPR35 (0.59) GPR35BCL2L1ALDH1A1KDM4EMEN1
SCHEMBL1659859 0.69 GPR35 (0.50) GPR35BCL2L1ALDH1A1KDM4EMEN1
SCHEMBL28905505 0.69 GPR35 (0.67) GPR35BCL2L1TSHRALDH1A1KDM4E
SCHEMBL31550325 0.69 GPR35 (0.46) GPR35BCL2L1ALDH1A1KDM4EMEN1
SCHEMBL1091530 0.69 BCL2L1 (0.53) GPR35BCL2L1ALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230021795-A1 METHODS OF PREPARING REGIOREGULAR CONJUGATED POLYMERS THE UNIVERSITY OF CHICAGO 2023-01-26 US disclosed
WO-2021101768-A1 METHODS OF PREPARING REGIOREGULAR CONJUGATED POLYMERS THE UNIVERSITY OF CHICAGO (US) 2021-05-27 WO disclosed
WO-2021101768-A1 METHODS OF PREPARING REGIOREGULAR CONJUGATED POLYMERS THE UNIVERSITY OF CHICAGO (US) 2021-05-27 WO disclosed