SCHEMBL3901554

SCHEMBL3901554

COC(=O)c1ccc(OS(=O)(=O)C(F)(F)F)cc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 4/20 0.44
HSD11B1 P28845 1/20 0.44
ESRRA P11474 1/20 0.43
CXCR2 P25025 2/20 0.42
NOTUM Q6P988 1/20 0.41
EPHX2 P34913 2/20 0.39
CXCR1 P25024 1/20 0.39
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38
TUBB2A Q13885 1/20 0.38
TUBB8 Q3ZCM7 1/20 0.38
TUBA3E Q6PEY2 1/20 0.38
TUBA1A Q71U36 1/20 0.38
TUBA1C Q9BQE3 1/20 0.38
TUBB6 Q9BUF5 1/20 0.38

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
SCHEMBL5569165 0.87 HSD11B1 (0.47) CFTRHSD11B1CXCR2CXCR1TUBB4A
SCHEMBL3902735 0.86 HSD11B1 (0.46) HSD11B1CXCR2CXCR1KDM4EHSD17B10
SCHEMBL3187945 0.86 KMT2A (0.45) CFTRHSD11B1CXCR2KDM4ESMN1; SMN2
SCHEMBL974920 0.84 HSD11B1 (0.45) CFTRHSD11B1CXCR2CXCR1STS
SCHEMBL3901811 0.84 HSD11B1 (0.45) CFTRHSD11B1CXCR2CXCR1TUBB4A
SCHEMBL3537593 0.84 CA12 (0.57) CFTRHSD11B1CXCR2STSSMN1; SMN2
SCHEMBL22979384 0.83 KDM4E (0.51) CFTRESRRANOTUMEPHX2TUBB4A
SCHEMBL3904794 0.81 HSD11B1 (0.43) CFTRHSD11B1CXCR2CXCR1STS
SCHEMBL12470804 0.81 CXCR2 (0.46) CFTRHSD11B1CXCR2CXCR1STS
SCHEMBL696042 0.80 XDH (0.48) CFTRESRRANOTUMEPHX2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4561575-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2025-06-04 EP disclosed
US-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE DAIICHI SANKYO COMPANY LIMITED (JP) 2009-12-31 US disclosed
US-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE DAIICHI SANKYO COMPANY LIMITED (JP) 2009-12-31 US disclosed
US-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE DAIICHI SANKYO COMPANY LIMITED (JP) 2009-12-31 US disclosed
EP-2017263-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-01-21 EP disclosed
EP-2017263-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-01-21 EP 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-20090324581-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE S1PR3, S1PR2, S1PR1 CFTR 1567/4885HSD11B1 836/4885ESRRA 1676/4885

“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.