SCHEMBL16263152

SCHEMBL16263152

CC(C)(C)Cn1cc(-c2cccc(N)c2)nn1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TEK Q02763 6/20 0.54
KDR P35968 6/20 0.54
EPHB4 P54760 3/20 0.54
UCHL5 Q9Y5K5 2/20 0.47
PRMT5 O14744 1/20 0.47
UCHL1 P09936 1/20 0.41
UCHL3 P15374 1/20 0.41
GGPS1 O95749 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
CYP19A1 P11511 1/20 0.41
ALOX5 P09917 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TSHR P16473 1/20 0.39
RECQL P46063 1/20 0.39
CA12 O43570 1/20 0.39
CA9 Q16790 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
SCHEMBL12251050 0.84 TEK (0.55) TEKKDREPHB4GGPS1GPR55
SCHEMBL16264699 0.84 TEK (0.57) TEKKDREPHB4UCHL5PRMT5
SCHEMBL30722374 0.84 TEK (0.57) TEKKDREPHB4UCHL5PRMT5
SCHEMBL16263163 0.82 ALOX5 (0.52) TEKKDREPHB4UCHL5UCHL1
SCHEMBL12251051 0.82 CYP19A1 (0.60) TEKKDREPHB4GGPS1CYP19A1
SCHEMBL21152040 0.81 TEK (0.46) TEKKDREPHB4UCHL5PRMT5
SCHEMBL14987759 0.81 TEK (0.55) TEKKDREPHB4UCHL5PRMT5
SCHEMBL18625808 0.80 PRMT5 (0.55) TEKKDREPHB4UCHL5PRMT5
SCHEMBL16263153 0.79 CYP19A1 (0.57) TEKKDREPHB4GGPS1CYP19A1
SCHEMBL28311174 0.78 TEK (0.55) TEKKDREPHB4UCHL5PRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 TEK 2749/4885KDR 4825/4885EPHB4 4570/4885
US-20140349954-A1 ANTIBACTERIAL TYLOSIN DERIVATIVES AND METHODS FOR THEIR PREPARATION MLN, TMSB10, TMSB4X TEK 1734/4885KDR 4839/4885EPHB4 4607/4885

“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.