SCHEMBL23554186

SCHEMBL23554186

c1ccc(COc2cccc(-c3cnc(Nc4ccccc4)o3)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.62
FLT1 P17948 9/20 0.62
FLT4 P35916 9/20 0.62
VCP P55072 4/20 0.61
IMPDH2 P12268 2/20 0.48
PRKDC P78527 1/20 0.47
ATM Q13315 1/20 0.47
DYRK1B Q9Y463 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL23539541 0.89 VCP (0.55) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5477362 0.84 MAPT (0.55) KDRFLT1FLT4VCPPRKDC
SCHEMBL5477528 0.84 VCP (0.80) KDRFLT1FLT4VCPIMPDH2
SCHEMBL23539644 0.80 PRKDC (0.51) KDRPRKDCATM
SCHEMBL5475234 0.80 MAOB (0.54) KDRPRKDCATM
SCHEMBL5184578 0.79 KDR (0.72) KDRFLT1FLT4VCPIMPDH2
Gw549390X SCHEMBL3295009 0.78 KDR (1.00) KDRFLT1FLT4VCPIMPDH2
SCHEMBL31061190 0.77 KDR (1.00) KDRFLT1FLT4VCPIMPDH2
SCHEMBL14492375 0.77 KDR (0.72) KDRFLT1FLT4VCPIMPDH2
SCHEMBL26307286 0.77 KDR (0.84) KDRFLT1FLT4VCPIMPDH2

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 4 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-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 KDR 867/4885FLT1 902/4885FLT4 864/4885
US-20230295147-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 KDR 867/4885FLT1 902/4885FLT4 864/4885
US-20210230153-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 KDR 867/4885FLT1 902/4885FLT4 864/4885

“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.