SCHEMBL11021411

SCHEMBL11021411

CC1(C(N)=O)CC(c2cccc(N3CCN(c4ccccc4F)CC3)c2)Nc2c([C]=O)cc(F)cc21

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ USP2 O75604 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ SMN1; SMN2 Q16637 6/20 0.33
▸ ALDH1A1 P00352 5/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ TSHR P16473 2/20 0.31
▸ PARP14 Q460N5 1/20 0.31
▸ PARP10 Q53GL7 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALOX15 P16050 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
SCHEMBL11029140 0.90 FAAH (0.33) MEN1KMT2AGAAALDH1A1HSD17B10
SCHEMBL11026764 0.84 NPC1 (0.34) MEN1KMT2AUSP2GAANPSR1
SCHEMBL11026336 0.82 CYP2C19 (0.34) MEN1KMT2AUSP2CYP1A2CYP2C9
SCHEMBL11021415 0.80 MEN1 (0.39) MEN1KMT2AUSP2GAACYP1A2
SCHEMBL11030189 0.80 HTR1A (0.34) MEN1KMT2AGAAALDH1A1NPSR1
SCHEMBL11028092 0.79 GBA1 (0.30) —
SCHEMBL11025411 0.78 CYP2C19 (0.39) MEN1KMT2ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL11030011 0.78 MEN1 (0.40) MEN1KMT2AUSP2GAACYP1A2
SCHEMBL11027130 0.77 CYP2C19 (0.41) MEN1KMT2ACYP2C9CYP2C19ALDH1A1
SCHEMBL11024631 0.76 KMT2A (0.41) MEN1KMT2AUSP2GAACYP1A2

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 MEN1 487/4885KMT2A 513/4885USP2 4302/4885

“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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