SCHEMBL7388485

SCHEMBL7388485

CCCCCCCc1ccc(C(=O)Nc2ccc(-n3nc(C(F)(F)F)cc3C(F)(F)F)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 3/20 0.67
TRPC3 Q13507 2/20 0.54
TRPC5 Q9UL62 1/20 0.54
TRPC1 P48995 1/20 0.52
STIM1 Q13586 1/20 0.52
TP53 P04637 2/20 0.52
THRB P10828 1/20 0.51
MAPT P10636 1/20 0.49
PLK1 P53350 1/20 0.49
TRPV1 Q8NER1 9/20 0.48
KDM4E B2RXH2 1/20 0.48
CRACR2A Q9BSW2 1/20 0.48
EPHX2 P34913 1/20 0.46

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
SCHEMBL7327505 0.87 ORAI1 (0.64) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7319822 0.85 ORAI1 (0.76) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7315257 0.82 ORAI1 (0.79) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7325708 0.82 ORAI1 (0.79) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7316335 0.82 ORAI1 (0.83) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7316026 0.82 ORAI1 (0.56) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7317754 0.81 ORAI1 (0.81) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7327988 0.81 ORAI1 (0.81) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7326875 0.81 ORAI1 (0.81) ORAI1TRPC3TRPC5TRPC1STIM1
SCHEMBL7319652 0.81 ORAI1 (0.81) ORAI1TRPC3TRPC5TRPC1STIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010044445-A1 AZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES 2001-11-22 US claimed
EP-1068187-A1 PYRAZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES (US) 2001-01-17 EP claimed
WO-1999051580-A1 PYRAZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES (US) 1999-10-14 WO claimed
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 4362/4885TRPC5 1739/4885

“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.