SCHEMBL21754248

SCHEMBL21754248

Oc1cccc2c(I)c[nH]c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.44
▸ HPGD P15428 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ PARP1 P09874 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ PARP15 Q460N3 1/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ ALOX15 P16050 2/20 0.38
▸ RECQL P46063 2/20 0.38
▸ APP P05067 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL29314342 0.84 DYRK1A (0.59) DYRK1AIMPDH2BRPF1GPR84CLK1
SCHEMBL9654333 0.79 HPGD (0.42) DYRK1AHPGDHSD17B10CYP1A2KDM4E
SCHEMBL17150712 0.77 TRIM24 (0.55) DYRK1ACYP1A2MAPTARBRPF1
SCHEMBL21636392 0.77 DYRK1A (0.55) DYRK1APARP1ARCLK1CDK5
SCHEMBL31302783 0.77 TRIM24 (0.55) DYRK1ACYP1A2MAPTARBRPF1
SCHEMBL27491481 0.75 HTT (0.54) DYRK1AHPGDKDM4EALDH1A1RAB9A
SCHEMBL6498006 0.74 HPGD (0.38) DYRK1AHPGDHSD17B10CYP1A2KDM4E
SCHEMBL5248011 0.74 ATM (0.48) HPGDHSD17B10CYP1A2KDM4EALDH1A1
SCHEMBL31424146 0.72 HTR2A (0.55) DYRK1AHPGDHSD17B10CYP1A2KDM4E
SCHEMBL3721357 0.72 TRIM24 (0.50) DYRK1AALDH1A1LMNABLMTDP1

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-11358969-B2 Indole AHR inhibitors and uses thereof Ikena Oncology, Inc. (US) 2022-06-14 — — US disclosed
US-20220144839-A1 INDOLE AHR INHIBITORS AND USES THEREOF PAHR THERAPEUTICS, INC. 2022-05-12 — — US disclosed
US-20200331917-A1 INDOLE AHR INHIBITORS AND USES THEREOF PAHR THERAPEUTICS, INC. 2020-10-22 — — 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 (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-10570138-B2 Indole AHR inhibitors and uses thereof AHR, ARNT, IDO1 DYRK1A 1156/4885HPGD 106/4885HSD17B10 192/4885
US-11358969-B2 Indole AHR inhibitors and uses thereof AHR, ARNT, IDO1 DYRK1A 1156/4885HPGD 106/4885HSD17B10 192/4885
US-20200331917-A1 INDOLE AHR INHIBITORS AND USES THEREOF AHR, ARNT, IDO1 DYRK1A 1156/4885HPGD 106/4885HSD17B10 192/4885
US-20220144839-A1 INDOLE AHR INHIBITORS AND USES THEREOF AHR, ARNT, IDO1 DYRK1A 1156/4885HPGD 106/4885HSD17B10 192/4885

“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.

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