SCHEMBL11025342

SCHEMBL11025342

CCc1ccc(N2CCOCC2)cc1C1CC(C)(C(N)=O)c2cc([C]=O)ccc2N1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGMN Q99538 1/20 0.34
▸ KIF11 P52732 4/20 0.34
▸ PRKDC P78527 1/20 0.33
▸ ALK Q9UM73 2/20 0.33
▸ ACACB O00763 1/20 0.33
▸ PRKAG1 P54619 1/20 0.32
▸ PRKAA1 Q13131 1/20 0.32
▸ PRKAB1 Q9Y478 1/20 0.32
▸ ABHD6 Q9BV23 1/20 0.32
▸ IDH1 O75874 3/20 0.31
▸ MAPT P10636 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ EML4 Q9HC35 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31

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
SCHEMBL11028239 0.89 MAPT (0.36) LGMNKIF11PRKDCALKACACB
SCHEMBL11025707 0.84 CYP2C19 (0.40) KIF11PRKDCALKIDH1MAPT
SCHEMBL11026361 0.81 F7 (0.32) —
SCHEMBL11029211 0.81 PRKAG1 (0.34) KIF11PRKDCALKPRKAG1PRKAA1
SCHEMBL11026606 0.81 MKNK1 (0.35) KIF11ALKIDH1MAPTMEN1
SCHEMBL11028016 0.80 PRKDC (0.39) KIF11PRKDCALKPRKAG1PRKAA1
SCHEMBL11025344 0.79 PRKAG1 (0.39) LGMNKIF11PRKDCPRKAG1PRKAA1
SCHEMBL11024487 0.77 KMO (0.42) LGMNKIF11PRKDCPRKAG1PRKAA1
SCHEMBL11026011 0.76 F11 (0.38) KIF11ALDH1A1MEN1KMT2AKDM4E
SCHEMBL11029425 0.74 SIRT2 (0.47) LGMNPRKAG1PRKAA1PRKAB1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809369-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2014-08-19 — — US claimed
EP-2668165-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2013-12-04 — — EP claimed
WO-2012101068-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-08-02 — — WO claimed
US-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — US claimed
US-8809369-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2014-08-19 — — US disclosed
EP-2668165-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2013-12-04 — — EP disclosed
WO-2012101068-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-08-02 — — WO disclosed
US-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — 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-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES RAB1A, RABL3, RAB7A LGMN 4662/4885KIF11 2739/4885PRKDC 4587/4885

“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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