SCHEMBL549209

SCHEMBL549209

O=C1N(c2ccccc2Cl)CCC12CCCNC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.46
ADRB1 P08588 1/20 0.42
ALOX5 P09917 2/20 0.39
RORC P51449 1/20 0.38
CYBB P04839 2/20 0.36
NOX5 Q96PH1 2/20 0.36
NOX4 Q9NPH5 2/20 0.36
NOX1 Q9Y5S8 2/20 0.36
HTR7 P34969 1/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
TSHR P16473 2/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
ALB P02768 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
LIPE Q05469 1/20 0.35
ALDH1A1 P00352 2/20 0.35
USP2 O75604 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
Hydrochloric Acid SCHEMBL550274 0.99 HSD11B1 (0.45) HSD11B1ADRB1ALOX5RORCCYBB
Hydrochloric Acid SCHEMBL5568924 0.99 HSD11B1 (0.45) HSD11B1ADRB1ALOX5RORCCYBB
Hydrochloric Acid SCHEMBL2699664 0.99 HSD11B1 (0.45) HSD11B1ADRB1ALOX5RORCCYBB
Hydrochloric Acid SCHEMBL5568920 0.96 HSD11B1 (0.43) HSD11B1ADRB1ALOX5RORCCYBB
SCHEMBL20103479 0.83 HSD11B1 (0.51) HSD11B1ALOX5HTR7TSHRALB
SCHEMBL14126633 0.81 RORC (0.47) HSD11B1RORCCYP3A4CYP2D6TSHR
Hydrochloric Acid SCHEMBL5431223 0.80 RORC (0.47) RORCCYP3A4CYP2D6TSHREGLN1
SCHEMBL2302148 0.76 HSD11B1 (0.47) HSD11B1ADRB1ALOX5TSHRALB
SCHEMBL18208964 0.74 HSD11B1 (0.51) HSD11B1ALOX5HTR7EGLN1LIPE
SCHEMBL18208689 0.74 HSD11B1 (0.51) HSD11B1ALOX5ALBEGLN1LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812005-B1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2015-09-16 EP disclosed
US-8563570-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2013-10-22 US disclosed
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US disclosed
EP-2450351-A1 Lactam compounds and their use as pharmaceuticals Incyte Corporation (US) 2012-05-09 EP disclosed
US-8110581-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-02-07 US disclosed
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 US disclosed
EP-1812005-A2 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-08-01 EP disclosed
US-20060116382-A1 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-06-01 US disclosed
WO-2006053024-A2 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-05-18 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 (3 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-20060116382-A1 Lactam compounds and their use as pharmaceuticals HSD11B1, HSD11B2, HSD17B1 HSD11B1 1/4885ADRB1 48/4885ALOX5 795/4885
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 HSD11B1 1/4885ADRB1 48/4885ALOX5 795/4885
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 HSD11B1 1/4885ADRB1 48/4885ALOX5 795/4885

“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.