SCHEMBL3039239

SCHEMBL3039239

O=C1CN(S(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2-c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 5/20 0.61
KCNN4 O15554 4/20 0.61
GAA P10253 1/20 0.45
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
CNR1 P21554 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PSEN1 P49768 3/20 0.36
PSEN2 P49810 3/20 0.36
APH1B Q8WW43 3/20 0.36
NCSTN Q92542 3/20 0.36
APH1A Q96BI3 3/20 0.36
PSENEN Q9NZ42 3/20 0.36
HTT P42858 1/20 0.36
BRS3 P32247 1/20 0.35
CHRM5 P08912 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
SCHEMBL3038159 0.81 KCNA3 (0.78) KCNA3KCNN4ALDH1A1MAPTPOLB
SCHEMBL3041480 0.76 KCNA3 (1.00) KCNA3KCNN4ALDH1A1MAPTPOLB
SCHEMBL3045470 0.76 KCNA3 (0.75) KCNA3KCNN4ALDH1A1MAPTPOLB
SCHEMBL3034555 0.76 KCNA3 (1.00) KCNA3KCNN4GAAALDH1A1MAPT
SCHEMBL3038345 0.75 KCNA3 (1.00) KCNA3KCNN4ALDH1A1MAPTPOLB
SCHEMBL3034521 0.74 KCNN4 (0.61) KCNA3KCNN4ALDH1A1
SCHEMBL8667382 0.74 KCNA3 (0.68) KCNA3KCNN4ALDH1A1MAPTPOLB
SCHEMBL3041693 0.73 KCNA3 (0.70) KCNA3KCNN4ALDH1A1MAPTPOLB
SCHEMBL28665779 0.70 KCNA3 (0.89) KCNA3KCNN4GAAALDH1A1MAPT
SCHEMBL3044118 0.69 KCNA3 (1.00) KCNA3KCNN4GAAALDH1A1MAPT

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-20100216772-A1 Novel Phenantridine Analogues and Uses Thereof 4SC AG (DE) 2010-08-26 US disclosed
EP-1740548-A1 NOVEL PHENANTRIDINE ANALOGUES AND THEIR USES AS INHIBITORS OF HYPERPROLIFERATION OF T CELLS AND/OR KERATINOCYTES 4SC AG (DE) 2007-01-10 EP disclosed
WO-2005105752-A1 NOVEL PHENANTRIDINE ANALOGUES AND THEIR USES AS INHIBITORS OF HYPERPROLIFERATION OF T CELLS AND/OR KERATINOCYTES 4SC AG (DE) 2005-11-10 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 (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-20100216772-A1 Novel Phenantridine Analogues and Uses Thereof P2RX4, P2RX5, CLIC4 KCNA3 52/4885KCNN4 50/4885GAA 3613/4885

“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.