SCHEMBL16264765

SCHEMBL16264765

CCn1cc(-c2cnc3ccccc3c2)nn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 3/20 0.44
▸ PDGFRA P16234 3/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP2A6 P11509 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ BIRC5 O15392 1/20 0.41
▸ GSK3B P49841 2/20 0.40
▸ PIK3CD O00329 1/20 0.40
▸ PIK3CA P42336 1/20 0.40
▸ FLT3 P36888 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ MAP4K4 O95819 1/20 0.40

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
SCHEMBL19387101 0.89 DRD2 (0.43) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL18625959 0.85 NAMPT (0.43) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL16263160 0.85 NPC1 (0.42) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL18625982 0.85 NPC1 (0.40) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL29009129 0.76 CA12 (0.46) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL30434942 0.76 CA12 (0.46) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL3777940 0.75 CYP19A1 (0.66) NPC1RAB9AMEN1KMT2ACYP19A1
SCHEMBL29009137 0.74 PDGFRB (0.46) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL30434559 0.74 PDGFRB (0.46) PDGFRBPDGFRANPC1MAPTRAB9A
Bromide SCHEMBL1887515 0.74 CYP19A1 (0.64) NPC1RAB9AMEN1KMT2ACYP19A1

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 PDGFRB 2716/4885PDGFRA 2490/4885NPC1 196/4885
US-20140349954-A1 ANTIBACTERIAL TYLOSIN DERIVATIVES AND METHODS FOR THEIR PREPARATION MLN, TMSB10, TMSB4X PDGFRB 2394/4885PDGFRA 1782/4885NPC1 428/4885

“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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