SCHEMBL7325966

SCHEMBL7325966

O=C(Nc1ccc(-n2nc(C(F)(F)F)nc2Cl)cc1)c1ccncc1F

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STIM1 Q13586 2/20 0.64
ORAI1 Q96D31 2/20 0.64
TRPC1 P48995 1/20 0.64
TRPC3 Q13507 1/20 0.64
CRACR2A Q9BSW2 5/20 0.59
EPHX2 P34913 4/20 0.45
ABL1 P00519 1/20 0.43
NR3C1 P04150 3/20 0.42
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40

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
SCHEMBL7325477 0.81 ORAI1 (0.79) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL30096576 0.78 ORAI1 (1.00) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL7325729 0.78 ORAI1 (1.00) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL7319538 0.77 ORAI1 (0.79) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL7322966 0.76 ORAI1 (0.76) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL7320569 0.75 ORAI1 (0.75) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL7323660 0.75 ORAI1 (0.75) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL7320209 0.75 ORAI1 (0.75) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL1882402 0.74 CRACR2A (1.00) STIM1ORAI1TRPC1TRPC3CRACR2A
SCHEMBL7320240 0.74 ORAI1 (0.74) STIM1ORAI1TRPC1TRPC3CRACR2A

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 6 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
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 STIM1 2302/4885ORAI1 3522/4885TRPC1 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.