SCHEMBL22326602

SCHEMBL22326602

FC(F)(F)c1cccc2cc(I)cnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.41
COPS5 Q92905 1/20 0.41
KDM4E B2RXH2 2/20 0.38
ESR1 P03372 1/20 0.38
PARP1 P09874 2/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
NR1H2 P55055 7/20 0.35
NR1H3 Q13133 6/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RORC P51449 1/20 0.34
CCR1 P32246 2/20 0.34
CCR5 P51681 2/20 0.34
CCR8 P51685 2/20 0.34

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
SCHEMBL22326604 0.81 PSMD14 (0.64) PSMD14COPS5KDM4EESR1PARP1
SCHEMBL3051052 0.79 PSMD14 (0.41) PSMD14COPS5KDM4EESR1PARP1
SCHEMBL8547571 0.79 PSMD14 (0.41) PSMD14COPS5KDM4EESR1PARP1
SCHEMBL24987024 0.77 PARP1 (0.55) PSMD14COPS5KDM4EESR1PARP1
SCHEMBL23717257 0.77 PSMD14 (0.42) PSMD14COPS5KDM4EESR1PARP1
SCHEMBL1666214 0.77 TET2 (0.44) PSMD14COPS5KDM4EALDH1A1CCR1
SCHEMBL13486493 0.77 KDM4E (0.44) PSMD14COPS5KDM4EESR1PARP1
SCHEMBL18739047 0.76 KDM4E (0.39) PSMD14COPS5KDM4EPARP1CCR1
SCHEMBL27707424 0.76 HPGDS (0.60) PSMD14COPS5PARP1NR1H2NR1H3
SCHEMBL28235432 0.74 PSMD14 (0.60) PSMD14COPS5PARP1NR1H2NR1H3

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-11219214-B2 Benzosultams and analogues and their use as fungicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2022-01-11 US disclosed
US-20200323211-A1 BENZOSULTAMS AND ANALOGUES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-10-15 US disclosed
US-10736321-B2 Benzosultams and analogues and their use as fungicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-08-11 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 (3 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-20200323211-A1 BENZOSULTAMS AND ANALOGUES AND THEIR USE AS FUNGICIDES GABBR1, DPM1, CYP51A1 PSMD14 2765/4885COPS5 773/4885KDM4E 347/4885
US-10736321-B2 Benzosultams and analogues and their use as fungicides GABBR1, DPM1, CYP51A1 PSMD14 2765/4885COPS5 773/4885KDM4E 347/4885
US-11219214-B2 Benzosultams and analogues and their use as fungicides GABBR1, DPM1, CYP51A1 PSMD14 2765/4885COPS5 773/4885KDM4E 347/4885

“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.