SCHEMBL7316538

SCHEMBL7316538

COc1ccc(C(=O)Nc2ccc(-n3nc(C(F)(F)F)cc3C(F)(F)F)cc2)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.64
ORAI1 Q96D31 3/20 0.62
TRPC3 Q13507 3/20 0.61
TRPC1 P48995 1/20 0.61
STIM1 Q13586 1/20 0.61
MAPT P10636 4/20 0.59
TP53 P04637 2/20 0.59
TRPC5 Q9UL62 1/20 0.57
JAK2 O60674 1/20 0.55
TYK2 P29597 1/20 0.55
NR3C1 P04150 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
AVPR2 P30518 1/20 0.50
GPR27 Q9NS67 1/20 0.50
F10 P00742 1/20 0.49
POLB P06746 1/20 0.48
PTGS2 P35354 1/20 0.47
CRACR2A Q9BSW2 2/20 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
SCHEMBL7318783 0.86 THRB (0.64) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7322306 0.86 ORAI1 (0.68) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7325351 0.85 ORAI1 (0.66) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7318760 0.85 ORAI1 (0.74) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7323117 0.84 ORAI1 (0.68) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7314694 0.84 ORAI1 (0.62) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7320259 0.83 ORAI1 (0.69) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7326603 0.83 ORAI1 (0.72) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7318553 0.82 ORAI1 (0.62) THRBORAI1TRPC3TRPC1STIM1
SCHEMBL7323503 0.82 ORAI1 (0.62) THRBORAI1TRPC3TRPC1STIM1

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 THRB 3730/4885ORAI1 3522/4885TRPC3 4362/4885

“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.