SCHEMBL2133363

SCHEMBL2133363

CCOC(=O)c1ccc2c(c1)C(C)(C)CC(c1ccccc1NC(=O)c1cccc(F)c1)N2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.53
POLB P06746 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
LMNA P02545 5/20 0.42
KDM4E B2RXH2 3/20 0.42
PAX8 Q06710 1/20 0.41
NR1H4 Q96RI1 1/20 0.39
MAPT P10636 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 1/20 0.38
GFER P55789 1/20 0.38
RAB9A P51151 5/20 0.38
NPC1 O15118 4/20 0.38
TP53 P04637 3/20 0.38
EPHX2 P34913 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 3/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL2137378 0.93 LMNA (0.51) SMN1; SMN2POLBTDP1LMNAKDM4E
SCHEMBL2136225 0.88 L3MBTL1 (0.44) SMN1; SMN2POLBTDP1LMNAKDM4E
SCHEMBL2136342 0.88 KDM4E (0.43) SMN1; SMN2POLBTDP1LMNAKDM4E
SCHEMBL2135798 0.85 NPSR1 (0.42) SMN1; SMN2POLBTDP1LMNAKDM4E
SCHEMBL16240119 0.83 LMNA (0.41) SMN1; SMN2POLBTDP1LMNAKDM4E
SCHEMBL2615615 0.83 SMN1; SMN2 (0.39) SMN1; SMN2POLBTDP1LMNAKDM4E
SCHEMBL2135975 0.81 LMNA (0.41) SMN1; SMN2TDP1LMNAKDM4EMAPT
SCHEMBL2141345 0.81 HPGD (0.42) SMN1; SMN2POLBKDM4EMAPTRAB9A
SCHEMBL2137420 0.80 PRKAB2 (0.45) SMN1; SMN2POLBTDP1LMNAKDM4E
SCHEMBL11025078 0.80 SMN1; SMN2 (0.48) SMN1; SMN2POLBLMNAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2630124-B1 TETRAHYDROQUINOLINE DERIVATIVES USED AS AMPK ACTIVATORS HOFFMANN LA ROCHE (CH) 2014-11-19 EP disclosed
US-8546427-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2013-10-01 US disclosed
US-20120101127-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES HUA MEDICINE (KY) 2012-04-26 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-20120101127-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES PRKAG1, PRKAB1, PRKAG2 SMN1; SMN2 4085/4885POLB 3819/4885TDP1 1697/4885

“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.