SCHEMBL23554168

SCHEMBL23554168

CSc1cccc(Nc2nc(Br)cs2)c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CFTR P13569 12/20 0.63
CCR4 P51679 1/20 0.45
KMT2A Q03164 3/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
ABCG2 Q9UNQ0 3/20 0.42
ABCC1 P33527 2/20 0.42
ABCB1 P08183 1/20 0.42
GAA P10253 1/20 0.42
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL12297692 0.79 CFTR (0.78) CFTRKMT2ARAB9AMEN1MAPT
SCHEMBL12298318 0.78 CFTR (0.80) CFTRKMT2ARAB9AMEN1MAPT
SCHEMBL12297180 0.76 CFTR (0.73) CFTRKMT2ARAB9AMEN1MAPT
SCHEMBL29042363 0.75 ROCK1 (0.48) CCR4KMT2ARAB9AMEN1MAPT
SCHEMBL12298456 0.75 CFTR (0.63) CFTRKMT2ARAB9AMEN1MAPT
SCHEMBL23554040 0.75 CFTR (0.66) CFTRKMT2ARAB9AMEN1MAPT
SCHEMBL12297696 0.75 CFTR (0.70) CFTRKMT2ARAB9AMEN1MAPT
SCHEMBL12298314 0.75 CFTR (0.75) CFTRKMT2ARAB9AMEN1MAPT
SCHEMBL23540119 0.74 VCP (0.62) CFTRKMT2AMEN1MAPTMAPK1
SCHEMBL30041339 0.74 VCP (0.62) CFTRKMT2AMEN1MAPTMAPK1

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 7 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-11608329-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof Ikena Oncology, Inc. (US) 2023-03-21 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 (4 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-11608329-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof AHR, ARNT, HCAR1 CFTR 709/4885CCR4 585/4885KMT2A 1031/4885
US-12030876-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof AHR, ARNT, HCAR1 CFTR 709/4885CCR4 585/4885KMT2A 1031/4885
US-20230295147-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 CFTR 709/4885CCR4 585/4885KMT2A 1031/4885
US-20210230153-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 CFTR 709/4885CCR4 585/4885KMT2A 1031/4885

“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.