SCHEMBL18952655

SCHEMBL18952655

CCOC(=O)NC(=S)Nc1nc(C)ccc1OCC(F)(F)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.42
▸ NPC1 O15118 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PDE5A O76074 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ AAK1 Q2M2I8 1/20 0.34
▸ POLB P06746 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ GAA P10253 3/20 0.33
▸ EPHX1 P07099 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL18952675 0.91 MAPT (0.43) MAPTNPC1TSHRKDM4EHPGD
SCHEMBL20609189 0.89 CNR2 (0.35) MAPTNPC1KDM4EKMT2AMEN1
SCHEMBL18952606 0.80 MAPT (0.39) MAPTNPC1TSHRKDM4EHPGD
SCHEMBL18952565 0.79 MAPT (0.39) MAPTNPC1TSHRKDM4EHPGD
SCHEMBL18952663 0.78 MAPT (0.38) MAPTKMT2AMEN1CNR2POLB
SCHEMBL18952492 0.76 ALDH1A1 (0.45) MAPTNPC1TSHRKDM4EKMT2A
SCHEMBL15537688 0.72 MAPT (0.42) MAPTHPGDPDE5AKMT2AMEN1
SCHEMBL18952659 0.72 MAPT (0.41) MAPTNPC1TSHRKDM4EHPGD
SCHEMBL21108337 0.72 MAPT (0.41) MAPTNPC1TSHRPDE5AKMT2A
SCHEMBL7841063 0.71 MAPT (0.42) MAPTNPC1TSHRKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3386978-B1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2021-01-27 — — EP disclosed
EP-3386978-B1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2021-01-27 — — EP disclosed
US-20200291034-A1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-09-17 — — US disclosed
US-20200291034-A1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-09-17 — — US disclosed
US-10562903-B2 Bridged piperidine derivatives HOFFMANN-LA ROCHE INC. (US) 2020-02-18 — — US disclosed
US-10562903-B2 Bridged piperidine derivatives HOFFMANN-LA ROCHE INC. (US) 2020-02-18 — — US disclosed
US-20190010156-A1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2019-01-10 — — US disclosed
EP-3386978-A1 BRIDGED PIPERIDINE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2018-10-17 — — EP disclosed
WO-2017097728-A1 BRIDGED PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-06-15 — — WO disclosed
WO-2017097728-A1 BRIDGED PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-06-15 — — 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 (3 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-20200291034-A1 BRIDGED PIPERIDINE DERIVATIVES PTGDR, HPGDS, PSEN1 MAPT 295/4885NPC1 440/4885TSHR 2539/4885
US-10562903-B2 Bridged piperidine derivatives PTGDR, HPGDS, PSEN1 MAPT 295/4885NPC1 440/4885TSHR 2539/4885
US-20190010156-A1 BRIDGED PIPERIDINE DERIVATIVES PTGDR, HPGDS, PSEN1 MAPT 295/4885NPC1 440/4885TSHR 2539/4885

“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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