SCHEMBL7323552

SCHEMBL7323552

CSc1cc(C(F)(F)F)nn1-c1ccc(NC(=O)c2ccccc2F)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 2/20 0.56
TRPC1 P48995 1/20 0.56
TRPC3 Q13507 1/20 0.56
STIM1 Q13586 1/20 0.56
CRACR2A Q9BSW2 4/20 0.56
MAPT P10636 7/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
THRB P10828 2/20 0.55
TP53 P04637 5/20 0.52
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 1/20 0.48
RAB9A P51151 1/20 0.48
MCL1 Q07820 1/20 0.48
LMNA P02545 1/20 0.47
TLR8 Q9NR97 1/20 0.47

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
SCHEMBL7320209 0.87 ORAI1 (0.75) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7316983 0.87 ORAI1 (0.51) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL14887700 0.86 CRACR2A (0.61) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7326834 0.85 ORAI1 (0.75) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7315926 0.84 ORAI1 (0.57) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7328210 0.83 MAPT (0.60) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7325414 0.81 ORAI1 (0.56) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7312592 0.80 ORAI1 (0.55) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7327436 0.80 MAPT (0.54) ORAI1TRPC1TRPC3STIM1CRACR2A
SCHEMBL7328081 0.80 KDM4E (0.63) ORAI1TRPC1TRPC3STIM1CRACR2A

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
US-20010044445-A1 AZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES 2001-11-22 US disclosed
EP-1068187-A1 PYRAZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES (US) 2001-01-17 EP disclosed
WO-1999051580-A1 PYRAZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES (US) 1999-10-14 WO 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 3522/4885TRPC1 4287/4885TRPC3 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.