SCHEMBL29474181

SCHEMBL29474181

O=S(=O)(Oc1c(-c2cccs2)ccc2c1cnn2C1CCCCO1)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
TSHR P16473 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
THRB P10828 1/20 0.35
HSD17B10 Q99714 2/20 0.33
HDAC3 O15379 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
GBA1 P04062 2/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
PDE8B O95263 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL11911452 0.79 RXRA (0.34) RXRARXRBRXRGALDH1A1MEN1
SCHEMBL30706815 0.78 RXRA (0.40) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL31348347 0.76 CYP4F2 (0.37) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL30723744 0.75 RXRA (0.36) RXRARXRBRXRG
SCHEMBL30707104 0.74 RXRA (0.37) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL30723894 0.74 RXRA (0.35) RXRARXRBRXRG
SCHEMBL31299364 0.74 RXRA (0.36) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL30724061 0.74 RXRA (0.36) RXRARXRBRXRG
SCHEMBL31348538 0.73 RXRA (0.36) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL29679902 0.73 RXRA (0.38) RXRARXRBRXRG

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
EP-4217358-A1 INDAZOLES AS HEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) INHIBITORS AND METHODS OF USING SAME 1st Biotherapeutics, Inc. (KR) 2023-08-02 EP disclosed
CN-114599651-A Indazoles as inhibitors of hematopoietic progenitor kinase 1(HPK1) and methods of use thereof 第一生物治疗股份有限公司 2022-06-07 CN disclosed
CN-114599653-A Indazoles as inhibitors of hematopoietic progenitor kinase 1(HPK1) and methods of use thereof 第一生物治疗股份有限公司 2022-06-07 CN disclosed
WO-2022064459-A1 INDAZOLES AS HEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) INHIBITORS AND METHODS OF USING SAME 1ST Biotherapeutics, Inc. (KR) 2022-03-31 WO disclosed
WO-2022064458-A1 INDAZOLES AS HEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) INHIBITORS AND METHODS OF USING SAME 1ST Biotherapeutics, Inc. (KR) 2022-03-31 WO disclosed