SCHEMBL18159957

SCHEMBL18159957

O=[N+]([O-])c1cn(Cn2cc(CN(Cc3ccccn3)Cc3ccccn3)nn2)cn1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 6/20 0.41
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LIN28A Q9H9Z2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HIF1A Q16665 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
CYP19A1 P11511 1/20 0.35

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
SCHEMBL18162860 0.82 HIF1A (0.33) HIF1ATAAR1L3MBTL1CYP19A1
SCHEMBL16619825 0.76 CYP19A1 (0.59) HSP90AB1L3MBTL1CYP19A1
SCHEMBL18028297 0.70 HSP90AB1 (0.70) HSP90AB1CYP19A1
SCHEMBL16626918 0.69 ALDH1A1 (0.49) HSP90AB1MAPTSMN1; SMN2
SCHEMBL23642697 0.68 MAPT (0.54) HSP90AB1MAPTSMN1; SMN2LIN28ATDP1
SCHEMBL18672838 0.68 MAPT (0.54) HSP90AB1MAPTSMN1; SMN2LIN28ATDP1
SCHEMBL30191149 0.68 SMN1; SMN2 (0.79) MAPTSMN1; SMN2LIN28ATDP1
SCHEMBL138261 0.66 SMN1; SMN2 (0.83) MAPTSMN1; SMN2LIN28ATDP1
SCHEMBL20393733 0.65 HSP90AB1 (0.45) HSP90AB1MAPTSMN1; SMN2LIN28ATDP1
SCHEMBL16620124 0.65 HSP90AB1 (0.61) HSP90AB1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9603953-B2 Dendrimer compositions, methods of synthesis, and uses thereof YANG, Guanghua (FR) 2017-03-28 US disclosed
US-9603953-B2 Dendrimer compositions, methods of synthesis, and uses thereof YANG, Guanghua (FR) 2017-03-28 US disclosed
US-20160303261-A1 DENDRIMER COMPOSITIONS, METHODS OF SYNTHESIS, AND USES THEREOF SADEG, Nouredine (FR) 2016-10-20 US disclosed
US-20160303261-A1 DENDRIMER COMPOSITIONS, METHODS OF SYNTHESIS, AND USES THEREOF SADEG, Nouredine (FR) 2016-10-20 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-20160303261-A1 DENDRIMER COMPOSITIONS, METHODS OF SYNTHESIS, AND USES THEREOF DDOST, CD44, CLTB HSP90AB1 2051/4885MAPT 324/4885SMN1; SMN2 676/4885

“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.