SCHEMBL2698255

SCHEMBL2698255

CC(C)(C)C(NC(=O)O)c1nnc2ccc(-c3cc(COC4CCCCO4)no3)nn12

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 8/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CREBBP Q92793 2/20 0.33
EP300 Q09472 1/20 0.33
HSD17B10 Q99714 3/20 0.32
HPGD P15428 2/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TP53 P04637 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL2697760 0.83 RXFP1 (0.37) RXFP1KDM4EALDH1A1SMN1; SMN2CREBBP
SCHEMBL2697765 0.81 RXFP1 (0.34) RXFP1KDM4EALDH1A1SMN1; SMN2CREBBP
SCHEMBL9910083 0.81 CA1 (0.36) RXFP1KDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL2698259 0.79 RXFP1 (0.32) RXFP1KDM4EALDH1A1SMN1; SMN2CREBBP
SCHEMBL6167181 0.64 PDE7A (0.43) ALDH1A1SMN1; SMN2HPGDTP53MEN1
SCHEMBL6608326 0.64 HDAC3 (0.42) ALDH1A1SMN1; SMN2HPGDTP53MEN1
SCHEMBL4146228 0.63 KDM4E (0.33) RXFP1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL6166741 0.63 MLLT1 (0.39) ALDH1A1SMN1; SMN2HPGDTP53MEN1
SCHEMBL2249806 0.62 CREBBP (0.40) ALDH1A1CREBBPEP300HSD17B10HPGD
SCHEMBL2015226 0.62 KDM4C (0.36) RXFP1ALDH1A1SMN1; SMN2HPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3093289-A1 [1,2,4]TRIAZOLO[4,3-A]PYRIDINE DERIVATIVES USEFUL AS INHIBITORS OF THE HEPATOCYTE GROWTH FACTOR RECEPTOR Amgen, Inc (US) 2016-11-16 EP disclosed
EP-2081931-B1 [1,2,4]Triazolo[4,3-a]pyridine derivatives useful as inhibitors of the hepatocyte growth factor receptor AMGEN INC (US) 2016-08-31 EP disclosed
US-9066954-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2015-06-30 US disclosed
US-20130303529-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC (US) 2013-11-14 US disclosed
US-8524900-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2013-09-03 US disclosed
EP-2578583-A1 Fused heterocyclic derivatives and methods of use Amgen Inc. (US) 2013-04-10 EP disclosed
US-8217177-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2012-07-10 US disclosed
US-8212041-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2012-07-03 US disclosed
US-20120148531-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-06-14 US disclosed
US-8198448-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2012-06-12 US disclosed
US-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-05-03 US disclosed
US-20090318436-A1 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2009-12-24 US disclosed
US-20090124612-A1 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2009-05-14 US disclosed
US-20090124609-A1 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2009-05-14 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 (6 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-20090318436-A1 Fused heterocyclic derivatives and methods of use HGF, HGFAC, MET RXFP1 3771/4885KDM4E 4500/4885ALDH1A1 156/4885
US-20120148531-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET RXFP1 3771/4885KDM4E 4500/4885ALDH1A1 156/4885
US-20090124612-A1 Fused heterocyclic derivatives and methods of use HGF, HGFAC, MET RXFP1 3771/4885KDM4E 4500/4885ALDH1A1 156/4885
US-20130303529-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET RXFP1 3771/4885KDM4E 4500/4885ALDH1A1 156/4885
US-20090124609-A1 Fused heterocyclic derivatives and methods of use HGF, HGFAC, MET RXFP1 3771/4885KDM4E 4500/4885ALDH1A1 156/4885
US-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET RXFP1 3771/4885KDM4E 4500/4885ALDH1A1 156/4885

“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.