SCHEMBL549292

SCHEMBL549292

O=C1N(C2CCOCC2)CC[C@]12CCCN(c1nccc(C(F)(F)F)n1)C2

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.41
ADRB1 P08588 1/20 0.41
CCR2 P41597 4/20 0.39
PKM P14618 2/20 0.39
KMT2A Q03164 1/20 0.39
LCAT P04180 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HTR2C P28335 3/20 0.38
HTR2A P28223 2/20 0.38
HTR2B P41595 2/20 0.38
CCR5 P51681 1/20 0.38
KCNH2 Q12809 1/20 0.38
HSD11B1 P28845 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.35
SLC6A7 Q99884 1/20 0.35
MAP3K12 Q12852 1/20 0.35
OGA O60502 1/20 0.35
CHRM4 P08173 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
SCHEMBL2699541 1.00 RBP4 (0.41) RBP4ADRB1CCR2PKMKMT2A
SCHEMBL550472 0.83 HCRTR1 (0.44) LCATHSD11B1OGACHRM4
SCHEMBL5930352 0.83 HCRTR1 (0.44) LCATHSD11B1OGACHRM4
SCHEMBL2699351 0.83 HCRTR1 (0.44) LCATHSD11B1OGACHRM4
SCHEMBL2698906 0.79 EPHX2 (0.41) LCATHSD11B1
SCHEMBL549583 0.79 EPHX2 (0.41) LCATHSD11B1
SCHEMBL2701224 0.79 HSD11B1 (0.38) KMT2AHSD11B1
SCHEMBL549966 0.79 HSD11B1 (0.38) KMT2AHSD11B1
SCHEMBL2705781 0.79 HSD11B1 (0.38) KMT2AHSD11B1
SCHEMBL550575 0.78 HTR7 (0.45) PKMLCATKDM4EHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8563570-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2013-10-22 US claimed
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US claimed
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 US claimed
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
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US disclosed
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US disclosed
US-8110581-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-02-07 US disclosed
US-8110581-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-02-07 US 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
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 US disclosed
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 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 (2 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-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 RBP4 4593/4885ADRB1 48/4885CCR2 3801/4885
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 RBP4 4593/4885ADRB1 48/4885CCR2 3801/4885

“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.