SCHEMBL2752090

SCHEMBL2752090

FC(F)(F)c1ccc(-c2n[c]cs2)cc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
MPL P40238 3/20 0.35
KIF11 P52732 3/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31

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
SCHEMBL2092788 0.77 KIF11 (0.44) KIF11
SCHEMBL2749974 0.74 CES2 (0.37) MPL
SCHEMBL2753490 0.74 IKBKB (0.36) RXRARXRBRXRG
SCHEMBL2750624 0.74 RAB9A (0.38) NOTUMCYP11B1CYP11B2
SCHEMBL2752028 0.72 MPL (0.33) NOTUMMPL
SCHEMBL2897475 0.71 HSD11B1 (0.45) NOTUMMPL
SCHEMBL2750143 0.71 CES2 (0.37) MPL
SCHEMBL695005 0.71 KDM4E (0.41)
SCHEMBL2752698 0.70 NOTUM (0.40) NOTUMRXRARXRBRXRGMPL
SCHEMBL2092347 0.70 AHR (0.46) NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178540-B2 Pyrimidylmethyl-sulfonamide compounds BASF SE (DE) 2012-05-15 US disclosed
US-20100077512-A1 Pyridazin-4-ylmethyl-sulfonamides used as Fungicides and Against Arthropods BASF SE (DE) 2010-03-25 US disclosed
US-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds BASF SE (DE) 2010-03-18 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-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds TPMT, NISCH, PPA1 NOTUM 772/4885RXRA 4567/4885RXRB 4758/4885
US-20100077512-A1 Pyridazin-4-ylmethyl-sulfonamides used as Fungicides and Against Arthropods PIR, PRDX4, PRDX2 NOTUM 618/4885RXRA 3505/4885RXRB 3867/4885

“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.