SCHEMBL18984755

SCHEMBL18984755

CN(C)CCCNc1ccc(NCCCN(C)C)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.67
BRCA1 P38398 1/20 0.67
HIF1A Q16665 1/20 0.67
TOP2B Q02880 3/20 0.57
MEN1 O00255 2/20 0.57
POLB P06746 2/20 0.57
BLM P54132 2/20 0.57
KMT2A Q03164 2/20 0.57
MAPT P10636 2/20 0.57
ALDH1A1 P00352 2/20 0.57
EGFR P00533 1/20 0.57
LMNA P02545 1/20 0.57
MAPK1 P28482 1/20 0.57
HTT P42858 1/20 0.57
RAD52 P43351 1/20 0.57
RECQL P46063 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
NSD2 O96028 3/20 0.55
RXFP1 Q9HBX9 1/20 0.55

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
SCHEMBL30818304 1.00 SMN1; SMN2 (0.67) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL6812028 0.94 SMN1; SMN2 (0.62) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
Hydrochloric Acid SCHEMBL4872203 0.93 SMN1; SMN2 (0.60) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL10046650 0.92 SMN1; SMN2 (0.73) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL2482880 0.92 SMN1; SMN2 (0.59) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL20482316 0.92 SMN1; SMN2 (0.59) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL31218590 0.90 MALT1 (0.62) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL29587040 0.90 MALT1 (0.62) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL7557626 0.90 MALT1 (0.62) SMN1; SMN2BRCA1HIF1ATOP2BMEN1
SCHEMBL31218593 0.90 MAPT (0.71) SMN1; SMN2BRCA1HIF1ATOP2BMEN1

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-20230181768-A1 TISSUE-TARGETING COMPLEX PHARMPUR GMBH (DE) 2023-06-15 US disclosed
US-10263308-B2 Solar flow battery CORNELL UNIVERSITY (US) 2019-04-16 US disclosed
US-10079401-B2 Symmetric redox flow battery containing organic redox active molecule CORNELL UNIVERSITY (US) 2018-09-18 US disclosed
US-20170187059-A1 SYMMETRIC REDOX FLOW BATTERY CONTAINING ORGANIC REDOX ACTIVE MOLECULE CORNELL UNIVERSITY (US) 2017-06-29 US disclosed
US-20170179558-A1 SOLAR FLOW BATTERY CORNELL UNIVERSITY (US) 2017-06-22 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-20230181768-A1 TISSUE-TARGETING COMPLEX ALK, CLTB, ACVR1B SMN1; SMN2 1838/4885BRCA1 3407/4885HIF1A 3473/4885

“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.