SCHEMBL23554173

SCHEMBL23554173

CC(C)(C)OC(=O)N(c1ccccc1)c1nc(-c2ccccc2)cs1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTO1 P78417 5/20 0.55
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
TP53 P04637 2/20 0.48
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 2/20 0.48
USP2 O75604 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
NFKB1 P19838 1/20 0.48
MAPK1 P28482 1/20 0.48
MMP13 P45452 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
HSD17B10 Q99714 1/20 0.48
USP30 Q70CQ3 2/20 0.48

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
SCHEMBL23554175 0.93 GSTO1 (0.49) GSTO1KMT2AMEN1L3MBTL1RAB9A
SCHEMBL23554220 0.91 MEN1 (0.53) GSTO1KMT2AMEN1L3MBTL1RAB9A
SCHEMBL1943940 0.81 KMT2A (0.57) GSTO1KMT2AMEN1L3MBTL1RAB9A
SCHEMBL16638071 0.81 HPGDS (0.43) GSTO1KMT2AMEN1RAB9ANPC1
SCHEMBL23554241 0.80 GRM1 (0.45) GSTO1KMT2AMEN1L3MBTL1LMNA
SCHEMBL10098812 0.79 GSTO1 (0.51) GSTO1KMT2AMEN1L3MBTL1RAB9A
SCHEMBL10098813 0.78 KMT2A (0.58) GSTO1KMT2AMEN1L3MBTL1RAB9A
SCHEMBL14409852 0.78 RAB9A (0.51) GSTO1KMT2AMEN1L3MBTL1RAB9A
SCHEMBL23554142 0.78 GSTO1 (0.38) GSTO1KMT2AMEN1L3MBTL1MAPT
SCHEMBL23539332 0.78 ALDH1A1 (0.42) GSTO1KMT2AMEN1L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030876-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof Ikena Oncology, Inc. (US) 2024-07-09 US disclosed
US-12030876-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof Ikena Oncology, Inc. (US) 2024-07-09 US disclosed
US-20230295147-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF ARYL THERAPEUTICS, INC. 2023-09-21 US disclosed
US-20230295147-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF ARYL THERAPEUTICS, INC. 2023-09-21 US disclosed
US-20210230153-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF ARYL THERAPEUTICS, INC. 2021-07-29 US disclosed
WO-2021127301-A1 4-PHENYL-N-(PHENYL)THIAZOL-2-AMINE DERIVATIVES AND RELATED COMPOUNDS AS ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS FOR THE TREATMENT OF E.G. ANGIOGENESIS IMPLICATED OR INFLAMMATORY DISORDERS Ikena Oncology, Inc. (US) 2021-06-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12030876-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof AHR, ARNT, HCAR1 GSTO1 950/4885KMT2A 1031/4885MEN1 4851/4885
US-20230295147-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 GSTO1 950/4885KMT2A 1031/4885MEN1 4851/4885
US-20210230153-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 GSTO1 950/4885KMT2A 1031/4885MEN1 4851/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.