SCHEMBL21754399

SCHEMBL21754399

CC(C)(C)OC(=O)NC1CCc2[nH]c3c(F)cc(F)cc3c2C1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
APOL1 O14791 2/20 0.40
PARP1 P09874 2/20 0.39
BRD4 O60885 2/20 0.38
CFTR P13569 1/20 0.38
PARP2 Q9UGN5 1/20 0.37
HTR1A P08908 1/20 0.37
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
KDM4D Q6B0I6 1/20 0.36

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
SCHEMBL7408004 0.85 APOL1 (0.43) APOL1CFTRHTR1AHTR1DHTR1B
SCHEMBL1903598 0.83 HTR1A (0.51) HTR1AHTR1DHTR1B
SCHEMBL1899834 0.83 HTR1A (0.51) HTR1AHTR1DHTR1B
SCHEMBL1899835 0.83 HTR1A (0.51) HTR1AHTR1DHTR1B
SCHEMBL7415604 0.83 MTNR1A (0.42) APOL1CFTRHTR1AHTR1DHTR1B
SCHEMBL7408320 0.79 HTR1A (0.46) APOL1CFTRHTR1AHTR1DHTR1B
SCHEMBL11344966 0.78 APOL1 (0.38) APOL1HTR1AHTR1DHTR1B
SCHEMBL6527927 0.77 DRD2 (0.43)
SCHEMBL7413287 0.76 APOL1 (0.37) APOL1CFTRHTR1AHTR1DHTR1B
SCHEMBL24408259 0.76 MTNR1A (0.47)

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
US-20230028336-A1 INDOLE AHR INHIBITORS AND USES THEREOF PAHR THERAPEUTICS, INC. 2023-01-26 US disclosed
US-11358969-B2 Indole AHR inhibitors and uses thereof Ikena Oncology, Inc. (US) 2022-06-14 US disclosed
US-20200331917-A1 INDOLE AHR INHIBITORS AND USES THEREOF PAHR THERAPEUTICS, INC. 2020-10-22 US disclosed
US-10689388-B1 Indole AHR inhibitors and uses thereof Ikena Oncology, Inc. (US) 2020-06-23 US disclosed
US-10570138-B2 Indole AHR inhibitors and uses thereof KYN THERAPEUTICS (US) 2020-02-25 US 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 (5 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-10570138-B2 Indole AHR inhibitors and uses thereof AHR, ARNT, IDO1 APOL1 4489/4885PARP1 2520/4885BRD4 371/4885
US-11358969-B2 Indole AHR inhibitors and uses thereof AHR, ARNT, IDO1 APOL1 4489/4885PARP1 2520/4885BRD4 371/4885
US-20200331917-A1 INDOLE AHR INHIBITORS AND USES THEREOF AHR, ARNT, IDO1 APOL1 4489/4885PARP1 2520/4885BRD4 371/4885
US-10689388-B1 Indole AHR inhibitors and uses thereof AHR, ARNT, IDO1 APOL1 4489/4885PARP1 2520/4885BRD4 371/4885
US-20230028336-A1 INDOLE AHR INHIBITORS AND USES THEREOF AHR, ARNT, IDO1 APOL1 4489/4885PARP1 2520/4885BRD4 371/4885

“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.