SCHEMBL22191397

SCHEMBL22191397

O=C(Nc1ccc(C(=O)Nc2ccccc2C(=O)O)cc1)c1ccc(I)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 2/20 0.68
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ PKM P14618 1/20 0.60
▸ POLB P06746 2/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ KCNK2 O95069 1/20 0.58
▸ KCNK10 P57789 1/20 0.58
▸ NPC1 O15118 2/20 0.57
▸ RAB9A P51151 2/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ SIRT2 Q8IXJ6 2/20 0.56
▸ TRPV1 Q8NER1 2/20 0.55
▸ HDAC3 O15379 1/20 0.55
▸ HDAC1 Q13547 1/20 0.55
▸ HDAC2 Q92769 1/20 0.55
▸ NCOR2 Q9Y618 1/20 0.55
▸ PPARG P37231 1/20 0.54
▸ PPARA Q07869 1/20 0.54
▸ NR1H4 Q96RI1 1/20 0.54

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
SCHEMBL5931215 0.94 DHODH (0.76) DHODHMEN1KMT2APKMKCNK2
SCHEMBL14855907 0.92 DHODH (0.73) DHODHMEN1KMT2APKMPOLB
SCHEMBL14087662 0.89 DHODH (0.69) DHODHMEN1KMT2APKMPOLB
SCHEMBL14075242 0.88 DHODH (0.88) DHODHMEN1KMT2APKMPOLB
SCHEMBL13870852 0.88 KMT2A (0.69) DHODHMEN1KMT2APKMPOLB
SCHEMBL2028671 0.87 DHODH (0.86) DHODHMEN1KMT2APKMKCNK2
SCHEMBL24312443 0.87 NPC1 (0.69) DHODHMEN1KMT2APKMPOLB
SCHEMBL13870857 0.87 DHODH (0.67) DHODHMEN1KMT2APKMPOLB
SCHEMBL14075282 0.85 ALOX15 (0.66) DHODHMEN1KMT2APKMPOLB
SCHEMBL22191760 0.84 KMT2A (0.76) DHODHMEN1KMT2APKMPOLB

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-20220073470-A1 INHIBITORS OF CGAS ACTIVITY AS THERAPEUTIC AGENTS BELLBROOK LABS, LLC 2022-03-10 — — US claimed
EP-3906229-A1 INHIBITORS OF CGAS ACTIVITY AS THERAPEUTIC AGENTS Bellbrook Labs, Llc (US) 2021-11-10 — — EP claimed
CN-113286785-A Inhibitors of cGAS activity as therapeutic agents 贝尔布鲁克实验室有限责任公司 2021-08-20 — — CN claimed
WO-2020142735-A1 INHIBITORS OF CGAS ACTIVITY AS THERAPEUTIC AGENTS BellBrook Labs (US) 2020-07-09 — — WO claimed
US-20220073470-A1 INHIBITORS OF CGAS ACTIVITY AS THERAPEUTIC AGENTS BELLBROOK LABS, LLC 2022-03-10 — — US disclosed
US-20220073470-A1 INHIBITORS OF CGAS ACTIVITY AS THERAPEUTIC AGENTS BELLBROOK LABS, LLC 2022-03-10 — — US disclosed
WO-2020142735-A1 INHIBITORS OF CGAS ACTIVITY AS THERAPEUTIC AGENTS BellBrook Labs (US) 2020-07-09 — — 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 (1 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-20220073470-A1 INHIBITORS OF CGAS ACTIVITY AS THERAPEUTIC AGENTS CGAS, STING1, IRF3 DHODH 2912/4885MEN1 3914/4885KMT2A 3981/4885

“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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