SCHEMBL7326241

SCHEMBL7326241

CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 3/20 0.66
CYP1A2 P05177 3/20 0.55
CYP3A4 P08684 3/20 0.55
CYP2C9 P11712 3/20 0.55
CYP2C19 P33261 3/20 0.55
CYP2D6 P10635 1/20 0.55
THRB P10828 1/20 0.52
TRPC3 Q13507 3/20 0.51
TP53 P04637 2/20 0.51
TRPC5 Q9UL62 1/20 0.51
MAPT P10636 2/20 0.51
TRPC1 P48995 1/20 0.49
STIM1 Q13586 1/20 0.49
PTGS2 P35354 3/20 0.47
ALDH1A1 P00352 1/20 0.47
PTGS1 P23219 2/20 0.46
P2RY1 P47900 1/20 0.46
TSHR P16473 1/20 0.46
THPO P40225 1/20 0.46
BLM P54132 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
SCHEMBL7321880 0.80 ORAI1 (1.00) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL5208645 0.80 ORAI1 (1.00) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL8611251 0.79 ORAI1 (0.74) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL2610067 0.78 CYP1A2 (0.81) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL7323892 0.77 ORAI1 (0.71) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL7325234 0.77 ORAI1 (0.67) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL7233105 0.76 ORAI1 (0.70) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL7323117 0.75 ORAI1 (0.68) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL7316538 0.75 THRB (0.64) ORAI1THRBTRPC3TP53TRPC5
SCHEMBL7318760 0.75 ORAI1 (0.74) ORAI1THRBTRPC3TP53TRPC5

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 3522/4885CYP1A2 42/4885CYP3A4 58/4885

“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.