SCHEMBL14734355

SCHEMBL14734355

COC(=O)CCC[C@@H](COC(=O)Nc1nnc(-c2ccc(N)cc2)s1)N(C)C(=O)NCc1cccc(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 7/20 0.38
CSNK2A1 P68400 7/20 0.38
KDM4E B2RXH2 7/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 4/20 0.34
HSD17B10 Q99714 4/20 0.34
HPGD P15428 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
USP2 O75604 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
GAA P10253 1/20 0.32
RCE1 Q9Y256 1/20 0.32
NOX1 Q9Y5S8 1/20 0.32

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
SCHEMBL2723939 0.94 CSNK2A2 (0.39) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL2724041 0.94 RXFP1 (0.40) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL2725740 0.94 CSNK2A2 (0.40) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL2725271 0.93 RAB9A (0.45) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL2724045 0.93 CSNK2A2 (0.38) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL2725250 0.93 CSNK2A2 (0.38) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL2725376 0.91 CSNK2A2 (0.37) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL2724127 0.91 KDM4E (0.43) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL213582 0.88 CSNK2A2 (0.42) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1
SCHEMBL211758 0.88 CSNK2A2 (0.41) CSNK2A2CSNK2A1KDM4ERAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2013-02-28 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 (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-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 CSNK2A2 534/4885CSNK2A1 714/4885KDM4E 3281/4885

“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.