SCHEMBL7246121

SCHEMBL7246121

Cc1ccc2cc(F)c(C(F)(F)F)cc2n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.49
CYP1A2 P05177 3/20 0.46
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
CASP6 P55212 1/20 0.42
MPL P40238 3/20 0.40
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38

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
SCHEMBL4058013 0.81 CYP1A2 (0.56) PTPN1CYP1A2KDM4ELMNAPOLB
SCHEMBL20047604 0.79 CYP1A2 (0.46) PTPN1CYP1A2KDM4ELMNAPOLB
SCHEMBL13737910 0.74 CYP1A2 (0.48) PTPN1CYP1A2KDM4ELMNAPOLB
SCHEMBL4052149 0.74 CYP1A2 (0.48) PTPN1CYP1A2KDM4ELMNAPOLB
SCHEMBL13739182 0.74 CYP1A2 (0.48) PTPN1CYP1A2KDM4ELMNAPOLB
SCHEMBL5342120 0.74 MPL (0.33) MPLCYP11B1CYP11B2
SCHEMBL10259445 0.73 CYP1A2 (0.68) CYP1A2KDM4ELMNAPOLBCASP6
SCHEMBL7243856 0.72 PDE10A (0.34) PTPN1MPLCYP11B1CYP11B2
SCHEMBL22754 0.72 CYP1A2 (0.55) PTPN1CYP1A2KDM4ELMNAPOLB
SCHEMBL13737717 0.71 CYP1A2 (0.46) CYP1A2KDM4ELMNAPOLBCASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030216571-A1 Antiallergens; antiinflammatory agents UBE INDUSTRIES, LTD. (JP) 2003-11-20 US disclosed
EP-1254897-A1 TRICYCLIC COMPOUNDS Ube Industries, Ltd. (JP) 2002-11-06 EP 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-20030216571-A1 Antiallergens; antiinflammatory agents CYSLTR2, CYSLTR1, LTC4S PTPN1 1940/4885CYP1A2 681/4885KDM4E 3264/4885

“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.