SCHEMBL18252671

SCHEMBL18252671

Cc1ccc2c(c1)sc1c2ccc2c3ccc(OS(=O)(=O)C(F)(F)F)cc3sc21

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 4/20 0.45
▸ CA2 P00918 4/20 0.45
▸ BCL2L1 Q07817 1/20 0.37
▸ MCL1 Q07820 1/20 0.37
▸ HTR1D P28221 5/20 0.36
▸ HTR1A P08908 4/20 0.36
▸ HTR1B P28222 4/20 0.36
▸ HTR2C P28335 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ RORC P51449 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ CXCR2 P25025 1/20 0.33
▸ STS P08842 1/20 0.32

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
SCHEMBL18255463 0.92 CA1 (0.51) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL18820393 0.79 CA2 (0.46) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL15318108 0.77 CA1 (0.49) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL15959747 0.77 CA1 (0.39) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL18252668 0.75 BCL2L1 (0.46) BCL2L1MCL1
SCHEMBL31243801 0.75 HSD11B1 (0.48) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL16811754 0.75 HSD11B1 (0.48) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL10023269 0.74 HTR1A (0.41) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL17552366 0.74 HTR1A (0.41) CA1CA2HTR1DHTR1AHTR1B
SCHEMBL15096687 0.74 HTR1A (0.41) CA1CA2HTR1DHTR1AHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160343958-A1 ORGANIC TRANSISTOR, COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, MATERIAL FOR ORGANIC TRANSISTOR, COATING SOLUTION FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, AND ORGANIC SEMICONDUCTOR FILM FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE FUJIFILM CORPORATION (JP) 2016-11-24 — — 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-20160343958-A1 ORGANIC TRANSISTOR, COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, MATERIAL FOR ORGANIC TRANSISTOR, COATING SOLUTION FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, AND ORGANIC SEMICONDUCTOR FILM FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE RO60, NONO, CNKSR1 CA1 979/4885CA2 2074/4885BCL2L1 877/4885

“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.

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