SCHEMBL16264766

SCHEMBL16264766

CCn1cc(-c2cc3ccccc3c3ccccc23)nn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 1/20 0.46
▸ CDK12 Q9NYV4 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.39
▸ KDM5C P41229 1/20 0.39
▸ KDM4C Q9H3R0 1/20 0.39
▸ KDM2A Q9Y2K7 1/20 0.39
▸ KDM3A Q9Y4C1 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ RET P07949 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP11B1 P15538 1/20 0.36
▸ CYP19A1 P11511 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MDM2 Q00987 1/20 0.36

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
SCHEMBL16263155 0.85 CCNE1 (0.37) CCNKCDK12CCNE1CDK2MEN1
SCHEMBL18625817 0.84 NAMPT (0.41) CCNKCDK12CCNE1CDK2MEN1
SCHEMBL22321061 0.82 CYP19A1 (0.59) CCNKCDK12KDM5CKDM4CKDM2A
SCHEMBL19723216 0.78 CCNK (0.37) CCNKCDK12KDM4EKDM5CKDM4C
SCHEMBL22868021 0.74 HDAC8 (0.53) CCNKCDK12KDM4EKDM5CKDM4C
SCHEMBL22868098 0.73 EPHB4 (0.54) CCNKCDK12KDM4EKDM5CKDM4C
SCHEMBL16264705 0.72 CCNK (0.44) CCNKCDK12KDM4EKDM5CKDM4C
SCHEMBL22868086 0.71 HDAC3 (0.57) CCNKCDK12MEN1KMT2AALDH1A1
Bromide SCHEMBL1887515 0.70 CYP19A1 (0.64) MEN1KMT2ACYP19A1NPC1RAB9A
SCHEMBL22868177 0.70 CA1 (0.48) CCNKCDK12RETCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2999707-B1 TYLOSIN DERIVATIVES AND METHOD FOR PREPARATION THEREOF BAYER ANIMAL HEALTH GMBH (DE) 2018-03-28 — — EP disclosed
EP-2782922-B1 ANTIBACTERIAL TYLOSIN DERIVATIVES AND METHODS FOR THEIR PREPARATION BAYER IP GMBH (DE) 2017-12-20 — — EP disclosed
US-9771389-B2 Tylosin derivatives and method for preparation thereof THE KITASAKO INSTITUTE (JP) 2017-09-26 — — US disclosed
US-9593140-B2 Antibacterial tylosin derivatives and methods for their preparation BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-03-14 — — US disclosed
US-20160108077-A1 TYLOSIN DERIVATIVES AND METHOD FOR PREPARATION THEREOF THE KITASAKO INSTITUTE (JP) 2016-04-21 — — US disclosed
US-20140349954-A1 ANTIBACTERIAL TYLOSIN DERIVATIVES AND METHODS FOR THEIR PREPARATION ELANCO ANIMAL HEALTH GMBH (DE) 2014-11-27 — — 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-20160108077-A1 TYLOSIN DERIVATIVES AND METHOD FOR PREPARATION THEREOF TMSB10, MLN, TMSB4X CCNK 4301/4885CDK12 4353/4885KDM4E 3500/4885
US-20140349954-A1 ANTIBACTERIAL TYLOSIN DERIVATIVES AND METHODS FOR THEIR PREPARATION MLN, TMSB10, TMSB4X CCNK 4163/4885CDK12 4731/4885KDM4E 3469/4885

“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.

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