SCHEMBL20535940

SCHEMBL20535940

Cc1ccc(S(=O)(=O)n2ccc3c(Cl)c(Br)cnc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
ABL1 P00519 2/20 0.45
BCR P11274 2/20 0.45
BRD4 O60885 3/20 0.44
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
PKM P14618 2/20 0.40
POLB P06746 1/20 0.39
ALDH3A1 P30838 1/20 0.39
HTT P42858 1/20 0.39
NOD1 Q9Y239 1/20 0.39
HTR6 P50406 2/20 0.38
RAPGEF4 Q8WZA2 1/20 0.38
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
ENPP3 O14638 1/20 0.36
ENPP1 P22413 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL3723254 0.87 CYP2C19 (0.48) L3MBTL1ABL1BCRPKMHTT
SCHEMBL1356064 0.87 L3MBTL1 (0.51) L3MBTL1ABL1BCRBRD4CA1
SCHEMBL30509477 0.87 L3MBTL1 (0.51) L3MBTL1BRD4CA1CA2PKM
SCHEMBL16052697 0.87 L3MBTL1 (0.51) L3MBTL1BRD4CA1CA2PKM
SCHEMBL1566001 0.86 L3MBTL1 (0.50) L3MBTL1ABL1BCRBRD4CA1
SCHEMBL1565879 0.85 L3MBTL1 (0.49) L3MBTL1ABL1BCRBRD4CA1
SCHEMBL29946541 0.85 L3MBTL1 (0.49) L3MBTL1ABL1BCRBRD4CA1
SCHEMBL1748728 0.85 L3MBTL1 (0.49) L3MBTL1BRD4CA1CA2PKM
SCHEMBL1718205 0.85 L3MBTL1 (0.49) L3MBTL1ABL1BCRBRD4CA1
SCHEMBL1933799 0.82 L3MBTL1 (0.47) L3MBTL1BRD4CA1CA2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220372034-A1 SUBSTITUTED PYRROLOPYRIDINES AS JAK INHIBITORS ACLARIS THERAPEUTICS, INC. 2022-11-24 US disclosed
US-11420966-B2 Substituted pyrrolopyridines as JAK inhibitors ACLARIS THERAPEUTICS, INC. 2022-08-23 US disclosed
US-20220235043-A1 SUBSTITUTED SULFONAMIDE PYRROLOPYRIDINES AS JAK INHIBITORS ACLARIS THERAPEUTICS, INC. 2022-07-28 US disclosed
CN-113727975-A Substituted pyrrolopyridines as JAK inhibitors 阿克拉瑞斯治疗股份有限公司 2021-11-30 CN disclosed
US-20200347053-A1 SUBSTITUTED PYRROLOPYRIDINES AS JAK INHIBITORS ACLARIS THERAPEUTICS, INC. 2020-11-05 US disclosed
WO-2020223728-A1 SUBSTITUTED PYRROLOPYRIDINES AS JAK INHIBITORS ACLARIS THERAPEUTICS, INC. (US) 2020-11-05 WO disclosed
US-20200071326-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS INC (US) 2020-03-05 US disclosed
WO-2018191587-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS, INC. (US) 2018-10-18 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 (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-20200071326-A1 TAM KINASE INHIBITORS PIK3CA, MAP3K1, MAP3K5 L3MBTL1 2882/4885ABL1 34/4885BCR 1122/4885
US-20220235043-A1 SUBSTITUTED SULFONAMIDE PYRROLOPYRIDINES AS JAK INHIBITORS JAK1, JAK3, JAK2 L3MBTL1 4809/4885ABL1 143/4885BCR 1398/4885
US-20200347053-A1 SUBSTITUTED PYRROLOPYRIDINES AS JAK INHIBITORS JAK1, JAK3, JAK2 L3MBTL1 4310/4885ABL1 228/4885BCR 2843/4885
US-20220372034-A1 SUBSTITUTED PYRROLOPYRIDINES AS JAK INHIBITORS JAK1, JAK3, JAK2 L3MBTL1 4310/4885ABL1 228/4885BCR 2843/4885
US-11420966-B2 Substituted pyrrolopyridines as JAK inhibitors JAK1, JAK3, JAK2 L3MBTL1 4310/4885ABL1 228/4885BCR 2843/4885

“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.