SCHEMBL4573594

SCHEMBL4573594

Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.74
CA2 P00918 2/20 0.74
HTT P42858 1/20 0.71
CA9 Q16790 1/20 0.71
KMT2A Q03164 3/20 0.68
KEAP1 Q14145 1/20 0.68
ALDH1A1 P00352 4/20 0.63
MAPK1 P28482 2/20 0.63
CYP3A4 P08684 2/20 0.63
MEN1 O00255 2/20 0.63
MAPT P10636 2/20 0.63
PRMT1 Q99873 1/20 0.63
CYP1A2 P05177 1/20 0.63
CYP2C19 P33261 1/20 0.63
CYP2C9 P11712 1/20 0.63
POLB P06746 2/20 0.61
FFAR4 Q5NUL3 2/20 0.59
PKM P14618 1/20 0.59
FFAR1 O14842 1/20 0.59

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
SCHEMBL3086764 1.00 CA1 (0.74) CA1CA2HTTCA9KMT2A
SCHEMBL11793140 0.90 CA1 (0.85) CA1CA2HTTCA9KMT2A
SCHEMBL540915 0.90 CA1 (0.85) CA1CA2HTTCA9KMT2A
SCHEMBL7501950 0.90 CA1 (0.81) CA1CA2KMT2AALDH1A1MAPK1
Hydrochloric Acid SCHEMBL5797806 0.88 CA1 (0.79) CA1CA2KMT2AALDH1A1MAPK1
SCHEMBL28352311 0.88 CA1 (0.59) CA1CA2HTTCA9KMT2A
SCHEMBL19603195 0.85 CA1 (0.76) CA1CA2HTTCA9KMT2A
SCHEMBL28352310 0.84 CA1 (0.55) CA1CA2HTTCA9KMT2A
SCHEMBL7834458 0.84 HTR6 (0.65) CA1CA2HTTCA9KMT2A
SCHEMBL153131 0.83 CA1 (1.00) CA1CA2HTTCA9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118084744-A Aloe-emodin derivative and preparation method and application thereof 广西民族大学 2024-05-28 CN disclosed
US-20230242496-A1 SOX11 INHIBITORS FOR TREATING MANTLE CELL LYMPHOMA ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2023-08-03 US disclosed
US-20230242496-A1 SOX11 INHIBITORS FOR TREATING MANTLE CELL LYMPHOMA ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2023-08-03 US disclosed
WO-2021257544-A1 SOX11 INHIBITORS FOR TREATING MANTLE CELL LYMPHOMA ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2021-12-23 WO disclosed
US-20080207632-A1 PROTEIN KINASE INHIBITORS SUPERGEN, INC. (US) 2008-08-28 US disclosed
US-20080207632-A1 PROTEIN KINASE INHIBITORS SUPERGEN, INC. (US) 2008-08-28 US disclosed
US-20080207632-A1 PROTEIN KINASE INHIBITORS SUPERGEN, INC. (US) 2008-08-28 US disclosed
WO-2008055233-A1 PROTEIN KINASE INHIBITORS SUPERGEN, INC. (US) 2008-05-08 WO disclosed
CN-1110489-C Benzisoelenazolone sulfamide derivative, its preparing process and its application in preparing medicines INST OF PHARMACOLOGY CHINESE A (CN) 2003-06-04 CN disclosed
CN-1253135-A Benzisoelenazolone sulfamide derivative, its preparing process and its application in preparing medicines INST OF PHARMACOLOGY CHINESE A (CN) 2000-05-17 CN 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 (2 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-20230242496-A1 SOX11 INHIBITORS FOR TREATING MANTLE CELL LYMPHOMA BCL6, SOX18, BCL3 CA1 3919/4885CA2 4239/4885HTT 4222/4885
US-20080207632-A1 PROTEIN KINASE INHIBITORS ERBB3, ERBB2, AXL CA1 3473/4885CA2 1825/4885HTT 4363/4885

“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.