SCHEMBL21243088

SCHEMBL21243088

Fc1c(Cl)cc(Br)c2cc[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.42
TNF P01375 1/20 0.35
RIPK1 Q13546 1/20 0.35
AHR P35869 2/20 0.33
EGFR P00533 1/20 0.33
RHEB Q15382 1/20 0.33
CCR8 P51685 1/20 0.32
PRKCI P41743 2/20 0.32
AXL P30530 1/20 0.32
KMT2A Q03164 1/20 0.31
PARP1 P09874 1/20 0.31

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
SCHEMBL31341960 0.85 CSNK2A1 (0.38) CSNK2A1TNFRIPK1AHREGFR
SCHEMBL31527469 0.85 CSNK2A1 (0.38) CSNK2A1TNFRIPK1AHREGFR
SCHEMBL16004965 0.81 AHR (0.35) CSNK2A1TNFRIPK1AHRRHEB
SCHEMBL26129610 0.81 CSNK2A1 (0.44) CSNK2A1TNFRIPK1AHREGFR
SCHEMBL30144058 0.81 AHR (0.35) CSNK2A1TNFRIPK1AHRRHEB
SCHEMBL24787431 0.78 CSNK2A1 (0.42) CSNK2A1AHREGFRRHEBCCR8
SCHEMBL24787449 0.78 TNF (0.47) CSNK2A1TNFRIPK1AHREGFR
SCHEMBL26145372 0.78 CSNK2A1 (0.42) CSNK2A1AHREGFRRHEBCCR8
SCHEMBL24215565 0.77 TNF (0.41) CSNK2A1TNFRIPK1AHRRHEB
SCHEMBL12748352 0.75 TNF (0.38) TNFRIPK1AHRRHEBCCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12522603-B2 Inhibitors of gas for treating autoinflammatory diseases and cancer metastasis THE ROCKEFELLER UNIVERSITY (US) 2026-01-13 US disclosed
EP-3937932-B1 INHIBITORS OF CGAS FOR TREATING AUTOINFLAMMATORY DISEASES AND CANCER METASTASIS UNIV ROCKEFELLER (US) 2025-01-08 EP disclosed
WO-2023235809-A1 CGAS INHIBITORS ELI LILLY AND COMPANY (US) 2023-12-07 WO disclosed
US-20230391786-A1 cGAS INHIBITORS ELI LILLY AND COMPANY 2023-12-07 US disclosed
US-11414422-B2 Substituted pyrido[4,3-b]indoles and azepino[4,5-b]indoles as inhibitors of cGAS THE ROCKEFELLER UNIVERSITY (US) 2022-08-16 US disclosed
CN-114901279-A Inhibitors of cGAS for the treatment of autoinflammatory diseases and cancer metastasis 洛克菲勒大学 2022-08-12 CN disclosed
US-20220185812-A1 INHIBITORS OF cGAS FOR TREATING AUTOINFLAMMATORY DISEASES AND CANCER METASTASIS THE ROCKEFELLER UNIVERSITY (US) 2022-06-16 US disclosed
EP-3749293-B1 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4, 3-B]INDOLE INHIBITORS OF CGAS FOR TREATING AUTOINFLAMMATORY DISEASES UNIV ROCKEFELLER (US) 2022-03-30 EP disclosed
EP-3937932-A1 INHIBITORS OF CGAS FOR TREATING AUTOINFLAMMATORY DISEASES AND CANCER METASTASIS Tomita, Daisuke (US) 2022-01-19 EP disclosed
US-20210155625-A1 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4, 3-b]INDOLE INHIBITORS OF cGAS FOR TREATING AUTOINFLAMMATORY DISEASES THE ROCKEFELLER UNIVERSITY (US) 2021-05-27 US disclosed
US-20210155625-A1 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4, 3-b]INDOLE INHIBITORS OF cGAS FOR TREATING AUTOINFLAMMATORY DISEASES THE ROCKEFELLER UNIVERSITY (US) 2021-05-27 US disclosed
WO-2020186027-A1 INHIBITORS OF CGAS FOR TREATING AUTOINFLAMMATORY DISEASES AND CANCER METASTASIS TOMITA DAISUKE (US) 2020-09-17 WO disclosed
WO-2020186027-A1 INHIBITORS OF CGAS FOR TREATING AUTOINFLAMMATORY DISEASES AND CANCER METASTASIS TOMITA DAISUKE (US) 2020-09-17 WO disclosed
WO-2019153002-A1 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4, 3-B]INDOLE INHIBITORS OF CGAS FOR TREATING AUTOINFLAMMATORY DISEASES LAMA LODOE (US) 2019-08-08 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-11414422-B2 Substituted pyrido[4,3-b]indoles and azepino[4,5-b]indoles as inhibitors of cGAS CGAS, STING1, IRF3 CSNK2A1 968/4885TNF 2327/4885RIPK1 782/4885
US-20220185812-A1 INHIBITORS OF cGAS FOR TREATING AUTOINFLAMMATORY DISEASES AND CANCER METASTASIS CGAS, STING1, IRF3 CSNK2A1 2393/4885TNF 628/4885RIPK1 212/4885
US-20230391786-A1 cGAS INHIBITORS CGAS, STING1, TBK1 CSNK2A1 238/4885TNF 1330/4885RIPK1 652/4885
US-20210155625-A1 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4, 3-b]INDOLE INHIBITORS OF cGAS FOR TREATING AUTOINFLAMMATORY DISEASES STING1, IRF3, CGAS CSNK2A1 1764/4885TNF 834/4885RIPK1 585/4885

“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.