SCHEMBL17987846

SCHEMBL17987846

CC(C)(C)OC(=O)NCC1Cc2cc(Br)cc(F)c2O1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 14/20 0.41
▸ AAK1 Q2M2I8 2/20 0.37
▸ DRD2 P14416 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ USP30 Q70CQ3 1/20 0.34

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
SCHEMBL5809553 0.86 EZH2 (0.44) RORCAAK1DRD2NAMPT
SCHEMBL15765023 0.85 MEN1 (0.38) RORCAAK1DRD2NAMPT
SCHEMBL15758544 0.83 AQP1 (0.33) —
SCHEMBL15764934 0.82 DRD2 (0.43) RORCDRD2NAMPT
SCHEMBL29116933 0.79 RORC (0.38) RORCDRD2NAMPT
SCHEMBL29116906 0.78 PARP1 (0.41) RORCDRD2
SCHEMBL15765045 0.78 EZH2 (0.40) RORCDRD2
SCHEMBL17987807 0.77 EZH2 (0.45) RORCDRD2NAMPT
SCHEMBL17974445 0.77 DRD2 (0.42) RORCDRD2NAMPT
SCHEMBL29116905 0.75 RORC (0.41) RORC

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-20160221994-A1 Substituted 2,3-Dihydrobenzofuranyl Compounds And Uses Thereof Karyopharm Therapeutics Inc. 2016-08-04 — — 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-20160221994-A1 Substituted 2,3-Dihydrobenzofuranyl Compounds And Uses Thereof BCL6, MALT1, BCL3 RORC 281/4885AAK1 4030/4885DRD2 2012/4885

“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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