SCHEMBL2302148

SCHEMBL2302148

O=C1N(c2ccccc2Cl)CCC12CCCN2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.47
ADRB1 P08588 1/20 0.41
ALOX5 P09917 2/20 0.40
ALB P02768 1/20 0.36
GSK3B P49841 1/20 0.36
PDE7A Q13946 1/20 0.36
PDE7B Q9NP56 1/20 0.36
HTR1A P08908 4/20 0.36
ADRA1B P35368 4/20 0.36
MAPT P10636 2/20 0.36
ADRA1A P35348 1/20 0.36
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
CASP1 P29466 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL549209 0.76 HSD11B1 (0.46) HSD11B1ADRB1ALOX5ALBHTR1A
Hydrochloric Acid SCHEMBL550274 0.75 HSD11B1 (0.45) HSD11B1ADRB1ALOX5ALBALDH1A1
Hydrochloric Acid SCHEMBL5568924 0.75 HSD11B1 (0.45) HSD11B1ADRB1ALOX5ALBALDH1A1
Hydrochloric Acid SCHEMBL2699664 0.75 HSD11B1 (0.45) HSD11B1ADRB1ALOX5ALBALDH1A1
SCHEMBL20103479 0.74 HSD11B1 (0.51) HSD11B1ALOX5ALBHTR1AADRA1B
Hydrochloric Acid SCHEMBL5568920 0.73 HSD11B1 (0.43) HSD11B1ADRB1ALOX5ALBHTR1A
SCHEMBL21151314 0.72 ADRB1 (0.41) HSD11B1ADRB1ALOX5GSK3BMAPT
SCHEMBL5319216 0.71 HSD11B1 (0.40) HSD11B1
SCHEMBL14016406 0.70 KMT2A (0.56) MAPTALDH1A1POLBTSHRL3MBTL1
SCHEMBL13879568 0.69 MGLL (0.47) ALOX5PDE7APDE7BMAPTALDH1A1

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-7998959-B2 Modulators of 11-β hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION (US) 2011-08-16 US disclosed
US-7998959-B2 Modulators of 11-β hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION (US) 2011-08-16 US disclosed
US-7998959-B2 Modulators of 11-β hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION (US) 2011-08-16 US disclosed
US-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-08-23 US disclosed
US-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-08-23 US disclosed
US-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-08-23 US disclosed
WO-2007084314-A2 MODULATORS OF 11-ß HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-07-26 WO disclosed
WO-2007084314-A2 MODULATORS OF 11-ß HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-07-26 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-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same HSD11B1, HSD17B1, HSD3B1 HSD11B1 1/4885ADRB1 301/4885ALOX5 432/4885

“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.