SCHEMBL15934192

SCHEMBL15934192

CC(C)(C)OC(=O)NCC1CN(S(=O)(=O)c2ccccc2Br)C1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.49
ACACB O00763 7/20 0.47
DRD2 P14416 2/20 0.45
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CKS1B P61024 1/20 0.44
SKP1 P63208 1/20 0.44
SKP2 Q13309 1/20 0.44
PKM P14618 1/20 0.42
EPHX2 P34913 2/20 0.41
ACACA Q13085 4/20 0.41
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39

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
SCHEMBL15916894 0.83 ALDH1A1 (0.46) KDM4EALDH1A1PKMEPHX2
SCHEMBL29987495 0.81 ACACB (0.47) NAMPTACACBDRD2
SCHEMBL22771095 0.81 ACACB (0.47) NAMPTACACBDRD2
SCHEMBL15934321 0.78 RAB9A (0.46) KDM4EALDH1A1
SCHEMBL15936742 0.77 NAMPT (0.47) NAMPTACACBDRD2KDM4ECKS1B
SCHEMBL25081005 0.77 NAMPT (0.67) NAMPTACACBDRD2KDM4ECKS1B
SCHEMBL15932411 0.76 BRD4 (0.56) DRD2KDM4EALDH1A1CKS1BSKP1
SCHEMBL21089377 0.76 NAMPT (0.56) NAMPTACACBDRD2KDM4ECKS1B
SCHEMBL15932410 0.76 BRD4 (0.56) DRD2KDM4EALDH1A1CKS1BSKP1
SCHEMBL24507851 0.76 RORC (0.51) NAMPTACACBDRD2CKS1BSKP1

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
EP-3495359-A1 FLAP MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 EP disclosed
EP-3070085-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-01-09 EP disclosed
US-9884878-B2 FLAP modulators JANSSEN PHARMACEUTICA NV (BE) 2018-02-06 US disclosed
US-9745328-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-29 US disclosed
US-20150376212-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-12-31 US disclosed
US-20150259357-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-09-17 US disclosed
US-9079866-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2015-07-14 US disclosed
US-20140221311-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (US) 2014-08-07 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 (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-20150376212-A1 FLAP MODULATORS FEN1, PGF, TBXA2R NAMPT 1496/4885ACACB 2937/4885DRD2 3158/4885
US-20150259357-A1 FLAP MODULATORS PGF, FEN1, TBXA2R NAMPT 1379/4885ACACB 2466/4885DRD2 3424/4885
US-20140221311-A1 FLAP MODULATORS PGF, FEN1, TBXA2R NAMPT 1379/4885ACACB 2466/4885DRD2 3424/4885

“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.