SCHEMBL3489476

SCHEMBL3489476

CCNS(=O)(=O)Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.53
KMT2A Q03164 1/20 0.45
ACLY P53396 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CYP19A1 P11511 1/20 0.43
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
PARP14 Q460N5 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CNR1 P21554 1/20 0.40

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
SCHEMBL24425798 0.84 KIF11 (0.51) KIF11KMT2AACLYCA1CA2
SCHEMBL9355 0.84 KIF11 (0.54) KIF11KMT2AACLYCA1CA2
SCHEMBL16914883 0.80 CA1 (0.58) KIF11KMT2AACLYCA1CA2
SCHEMBL24429452 0.79 KMT2A (0.51) KMT2ACA1CA2L3MBTL1
SCHEMBL14378212 0.79 KIF11 (0.58) KIF11KMT2ACA1CA2CYP19A1
SCHEMBL18571239 0.79 KIF11 (0.50) KIF11KMT2AACLYCA1CA2
SCHEMBL26212936 0.79 KIF11 (0.50) KIF11KMT2AACLYCA1CA2
SCHEMBL18571409 0.78 MMP1 (0.46) KIF11KMT2ACA1CA2BCHE
SCHEMBL18571399 0.77 ALDH1A1 (0.57) KMT2ACA1CA2L3MBTL1
SCHEMBL2375558 0.77 KIF11 (0.59) KIF11KMT2ACA1CA2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109988110-B 4-phenoxy quinoline sulfonylurea compound, intermediate for synthesizing the compound and its preparation method and use 威海海洋生物医药产业技术研究院有限公司 2022-07-01 CN disclosed
US-20100016321-A1 DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATOR ASTRAZENECA AB (SE) 2010-01-21 US disclosed
US-7582629-B2 Derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2009-09-01 US disclosed
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2008-10-16 US 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-20100016321-A1 DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATOR NR1H2, NR1H3, NR1I2 KIF11 4303/4885KMT2A 3077/4885ACLY 380/4885
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 KIF11 4318/4885KMT2A 3198/4885ACLY 357/4885

“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.