SCHEMBL4574701

SCHEMBL4574701

O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.40
▸ NPY1R P25929 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ MMP8 P22894 1/20 0.38
▸ MMP13 P45452 1/20 0.38
▸ LMNA P02545 1/20 0.36
▸ VCAM1 P19320 1/20 0.36
▸ F2 P00734 1/20 0.35
▸ PRSS1 P07477 1/20 0.35
▸ PRSS2 P07478 1/20 0.35
▸ PRSS3 P35030 1/20 0.35
▸ CYP19A1 P11511 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
SCHEMBL30928268 0.85 KMT2A (0.55) KMT2AMEN1NPC1NPY1RALDH1A1
SCHEMBL6052931 0.82 KMT2A (0.43) KMT2AMEN1NPC1NPY1RALDH1A1
SCHEMBL2062279 0.82 KMT2A (0.43) KMT2AMEN1NPC1NPY1RALDH1A1
SCHEMBL28105323 0.82 KMT2A (0.43) KMT2AMEN1NPC1NPY1RALDH1A1
SCHEMBL29290020 0.82 KMT2A (0.43) KMT2AMEN1NPC1NPY1RALDH1A1
SCHEMBL457277 0.80 KMT2A (0.53) KMT2AMEN1ALDH1A1TDP1CA1
SCHEMBL9763798 0.80 HSP90AA1 (0.42) KMT2AMEN1NPY1RALDH1A1TDP1
SCHEMBL31294204 0.80 KMT2A (0.53) KMT2AMEN1ALDH1A1TDP1CA1
SCHEMBL30267714 0.79 KMT2A (0.39) KMT2AMEN1ALDH1A1TDP1CA1
SCHEMBL21834662 0.79 KMT2A (0.39) KMT2AMEN1ALDH1A1TDP1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108698982-B Fluorine atom-containing compound and use thereof 日产化学工业株式会社 2021-07-16 — — CN disclosed
EP-3404017-B1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF NISSAN CHEMICAL IND LTD (JP) 2020-05-13 — — EP disclosed
US-10336686-B2 Fluorine atom-containing compound and use thereof NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-07-02 — — US disclosed
US-20190031600-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-01-31 — — US disclosed
EP-3404017-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF Nissan Chemical Industries, Ltd. (JP) 2018-11-21 — — EP disclosed
CN-103492028-B Sulfonaminoquinoline hepcidin antagonists 维福(国际)股份公司 2017-02-08 — — CN disclosed
US-7393849-B2 Substituted sulfonamides and ureas useful for inhibiting kinase activity AVENTIS PHARMACEUTICALS INC. (US) 2008-07-01 — — US disclosed
US-7323457-B2 Substituted sulfonamides and ureas useful for inhibiting kinase activity AVENTIS PHARMACEUTICALS INC. (US) 2008-01-29 — — US disclosed
US-20070208008-A1 SUBSTITUTED SULFONAMIDES AND UREAS USEFUL FOR INHIBITING KINASE ACTIVITY AVENTIS PHARMACEUTICALS INC. (US) 2007-09-06 — — US disclosed
US-20070191347-A1 SUBSTITUTED SULFONAMIDES AND UREAS USEFUL FOR INHIBITING KINASE ACTIVITY AVENTIS PHARMACEUTICALS INC. 2007-08-16 — — US disclosed
US-7223763-B2 Substituted sulfonamides and ureas useful for inhibiting kinase activity AVENTIS PHARMACEUTICALS INC. (US) 2007-05-29 — — US disclosed
EP-1423373-B1 SUBSTITUTED AMIDES, SULFONAMIDES AND UREAS USEFUL FOR INHIBITING KINASE ACTIVITY AVENTIS PHARMA INC (US) 2005-10-19 — — EP disclosed
US-20040204582-A1 Substituted sulfonamides and ureas useful for inhibiting kinase activity AVENTIS PHARMACEUTICALS INC. 2004-10-14 — — US disclosed
US-6777577-B2 ANTICANCER AGENTS; ANTIDIABETIC AGENTS, ANTICHOLESTEROL AGENTS, CARDIOVASCULAR DISORDERS, OSTEOPOROSIS AVENTIS PHARMACEUTICALS INC. 2004-08-17 — — US disclosed
EP-1423373-A2 SUBSTITUTED AMIDES, SULFONAMIDES AND UREAS USEFUL FOR INHIBITING KINASE ACTIVITY Aventis Pharmaceuticals, Inc. (US) 2004-06-02 — — EP disclosed
US-20030087832-A1 Substituted amides, sulfonamides and ureas useful for inhibiting kinase activity AVENTIS PHARMACEUTICALS INC. 2003-05-08 — — US disclosed
US-20030045480-A1 Method of treating hyperresorptive bone disorders ARIAD PHARMACEUTICALS, INC. 2003-03-06 — — US disclosed
WO-2003006444-A2 SUBSTITUTED AMIDES, SULFONAMIDES AND UREAS USEFUL FOR INHIBITING KINASE ACTIVITY AVENTIS PHARMACEUTICALS INC. (US) 2003-01-23 — — 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 (7 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-10336686-B2 Fluorine atom-containing compound and use thereof ARF1, ARF5, ARFGAP1 KMT2A 1622/4885MEN1 755/4885NPC1 46/4885
US-20070208008-A1 SUBSTITUTED SULFONAMIDES AND UREAS USEFUL FOR INHIBITING KINASE ACTIVITY CHUK, SRC, DSTYK KMT2A 1067/4885MEN1 4554/4885NPC1 4486/4885
US-20040204582-A1 Substituted sulfonamides and ureas useful for inhibiting kinase activity CHUK, SRC, DSTYK KMT2A 1104/4885MEN1 4490/4885NPC1 4422/4885
US-20030045480-A1 Method of treating hyperresorptive bone disorders SRC, GRB2, ACP1 KMT2A 1735/4885MEN1 3737/4885NPC1 4321/4885
US-20070191347-A1 SUBSTITUTED SULFONAMIDES AND UREAS USEFUL FOR INHIBITING KINASE ACTIVITY CHUK, SRC, DSTYK KMT2A 1067/4885MEN1 4554/4885NPC1 4486/4885
US-20190031600-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF ARF1, ARF5, ARFGAP1 KMT2A 1622/4885MEN1 755/4885NPC1 46/4885
US-20030087832-A1 Substituted amides, sulfonamides and ureas useful for inhibiting kinase activity SRC, CHUK, DSTYK KMT2A 693/4885MEN1 4371/4885NPC1 4154/4885

“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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