SCHEMBL3390177

SCHEMBL3390177

O=C(N[C@H]1CCc2ccccc2C1)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HSD11B1 P28845 1/20 0.48
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MTNR1A P48039 3/20 0.45
MTNR1B P49286 3/20 0.45
DDR1 Q08345 1/20 0.42
MAPK11 Q15759 1/20 0.42
MAPK14 Q16539 1/20 0.42
DDR2 Q16832 1/20 0.42
TMEM97 Q5BJF2 1/20 0.42
MAP3K20 Q9NYL2 1/20 0.42
MAP3K2 Q9Y2U5 1/20 0.42
GPR6 P46095 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
DRD2 P14416 1/20 0.42
DRD1 P21728 1/20 0.42

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
SCHEMBL3423825 1.00 KDM4E (0.49) KDM4EALDH1A1HSD11B1MAPTPOLB
SCHEMBL10366974 0.86 HSD11B1 (0.56) KDM4EALDH1A1HSD11B1MAPTPOLB
SCHEMBL2857566 0.85 CNR1 (0.54) KDM4EALDH1A1HSD11B1MAPTPOLB
SCHEMBL2851938 0.84 SPR (0.56) KDM4EALDH1A1HSD11B1MAPTPOLB
SCHEMBL3423831 0.82 ALDH1A1 (0.55) KDM4EALDH1A1SMN1; SMN2LMNASPR
SCHEMBL3390180 0.82 ALDH1A1 (0.55) KDM4EALDH1A1SMN1; SMN2LMNASPR
SCHEMBL2854286 0.81 HSD11B1 (0.52) KDM4EALDH1A1HSD11B1MAPTPOLB
SCHEMBL10365365 0.79 ALDH1A1 (0.69) KDM4EALDH1A1HSD11B1MAPTPOLB
SCHEMBL2852540 0.77 KDM4E (0.66) KDM4EALDH1A1HSD11B1MAPTPOLB
SCHEMBL2854682 0.77 ALDH1A1 (0.60) KDM4EALDH1A1HSD11B1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370530-B1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL SANOFI AVENTIS DEUTSCHLAND (DE) 2010-12-29 EP disclosed
US-6949556-B2 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-09-27 US disclosed
EP-1370530-A1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL Aventis Pharma Deutschland GmbH (DE) 2003-12-17 EP disclosed
US-20030022935-A1 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-01-30 US disclosed
WO-2002064565-A1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-08-22 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 (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-20030022935-A1 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents VEGFA, EDNRA, NR1H2 KDM4E 460/4885ALDH1A1 509/4885HSD11B1 464/4885

“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.