SCHEMBL6864949

SCHEMBL6864949

CCN(CCN(Cc1ccccn1)Cc1ccccn1)Cc1ccccn1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.81
MAPT P10636 1/20 0.81
SMN1; SMN2 Q16637 1/20 0.81
LIN28A Q9H9Z2 1/20 0.81
DRD2 P14416 1/20 0.49
HTR2A P28223 1/20 0.49
TSHR P16473 4/20 0.46
KDM4E B2RXH2 3/20 0.46
POLB P06746 1/20 0.46
TERT O14746 1/20 0.45
KCNA5 P22460 3/20 0.45
KMT2A Q03164 2/20 0.44
CYP2D6 P10635 1/20 0.44
KCNE1 P15382 1/20 0.44
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL12338697 0.98 TDP1 (0.78) TDP1MAPTSMN1; SMN2LIN28ADRD2
SCHEMBL8604224 0.90 TDP1 (0.70) TDP1MAPTSMN1; SMN2LIN28ADRD2
SCHEMBL29877048 0.90 TDP1 (0.70) TDP1MAPTSMN1; SMN2LIN28ADRD2
SCHEMBL804309 0.90 TDP1 (0.70) TDP1MAPTSMN1; SMN2LIN28ADRD2
SCHEMBL29427509 0.90 TDP1 (1.00) TDP1MAPTSMN1; SMN2LIN28ATSHR
SCHEMBL231092 0.90 TDP1 (1.00) TDP1MAPTSMN1; SMN2LIN28ATSHR
SCHEMBL10609540 0.88 TDP1 (0.96) TDP1MAPTSMN1; SMN2LIN28ATSHR
SCHEMBL11471516 0.88 TDP1 (0.62) TDP1MAPTSMN1; SMN2LIN28ADRD2
SCHEMBL13555816 0.88 TDP1 (0.62) TDP1MAPTSMN1; SMN2LIN28ADRD2
SCHEMBL29893315 0.87 TDP1 (0.78) TDP1MAPTSMN1; SMN2LIN28ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11125741-B2 Compositions and methods for the detection of zinc NORTHWESTERN UNIVERSITY (US) 2021-09-21 US disclosed
EP-3497095-B1 ZINC CHELATING COMPOUNDS FOR USE IN THE TREATMENT OF BACTERIAL INFECTION UNIV OSLO (NO) 2021-07-14 EP disclosed
US-20190033299-A1 COMPOSITIONS AND METHODS FOR THE DETECTION OF ZINC NORTHWESTERN UNIVERSITY 2019-01-31 US disclosed
WO-2018033719-A1 COMPOUNDS UNIVERSITETET I OSLO (NO) 2018-02-22 WO disclosed
US-9897595-B2 Compositions and methods for the detection of zinc NORTHWESTERN UNIVERSITY (US) 2018-02-20 US disclosed
EP-1008645-B1 Detergent bleaching compositions UNILEVER PLC (GB) 2004-07-21 EP disclosed
US-6165963-A Detergent bleaching composition comprising pentadentate ligand derivatives UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. (US) 2000-12-26 US disclosed
EP-1008645-A1 Detergent bleaching compositions UNILEVER PLC (GB) 2000-06-14 EP disclosed
WO-2000027975-A1 DETERGENT BLEACHING COMPOSITION UNILEVER PLC (GB) 2000-05-18 WO 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-11125741-B2 Compositions and methods for the detection of zinc SLC30A6, SLC39A3, SLC30A7 TDP1 2876/4885MAPT 1975/4885SMN1; SMN2 1520/4885
US-20190033299-A1 COMPOSITIONS AND METHODS FOR THE DETECTION OF ZINC SLC30A6, SLC39A3, SLC30A7 TDP1 2876/4885MAPT 1975/4885SMN1; SMN2 1520/4885

“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.