SCHEMBL7323503

SCHEMBL7323503

N#Cc1ccc(C(=O)Nc2ccc(-n3nc(C(F)(F)F)cc3C(F)(F)F)cc2)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 3/20 0.62
TRPC3 Q13507 3/20 0.61
TRPC1 P48995 1/20 0.61
STIM1 Q13586 1/20 0.61
TP53 P04637 3/20 0.52
TRPC5 Q9UL62 1/20 0.52
MAPT P10636 2/20 0.50
AVPR2 P30518 1/20 0.50
GPR27 Q9NS67 1/20 0.50
THRB P10828 2/20 0.49
CRACR2A Q9BSW2 5/20 0.46
SMN1; SMN2 Q16637 1/20 0.42
EPHX2 P34913 1/20 0.41
FLT1 P17948 1/20 0.41
FLT4 P35916 1/20 0.41
KDR P35968 1/20 0.41
TMPRSS4 Q9NRS4 1/20 0.41

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
SCHEMBL7322306 0.86 ORAI1 (0.68) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7325351 0.85 ORAI1 (0.66) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7318446 0.85 ORAI1 (0.74) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7326377 0.85 ORAI1 (0.74) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7320259 0.83 ORAI1 (0.69) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7326603 0.83 ORAI1 (0.72) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7316538 0.82 THRB (0.64) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7318553 0.82 ORAI1 (0.62) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7314694 0.82 ORAI1 (0.62) ORAI1TRPC3TRPC1STIM1TP53
SCHEMBL7326066 0.82 ORAI1 (0.64) ORAI1TRPC3TRPC1STIM1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010044445-A1 AZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES 2001-11-22 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 (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-20010044445-A1 AZOLE INHIBITORS OF CYTOKINE PRODUCTION IL5, IL2, IL4 ORAI1 3522/4885TRPC3 4362/4885TRPC1 4287/4885

“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.