SCHEMBL6835310

SCHEMBL6835310

CN(C)Nc1ccc(N(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.58
TSHR P16473 5/20 0.58
HSD17B10 Q99714 3/20 0.58
ALOX15 P16050 2/20 0.58
MAPT P10636 7/20 0.48
KMT2A Q03164 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
GAA P10253 2/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
TDP1 Q9NUW8 5/20 0.46
MAPK1 P28482 5/20 0.46
TP53 P04637 3/20 0.46
CYP3A4 P08684 2/20 0.46
MEN1 O00255 3/20 0.43
KDM4E B2RXH2 2/20 0.43
THRB P10828 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL9479616 0.78 ALDH1A1 (0.65) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL222247 0.78 ALDH1A1 (0.65) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL65261 0.76 ALDH1A1 (1.00) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL146321 0.76 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL2409779 0.76 HPGD (0.46) ALDH1A1TSHRMAPTKMT2ASMN1; SMN2
SCHEMBL1767117 0.74 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10ALOX15MAPT
Hydrochloric Acid SCHEMBL9693558 0.74 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL20377494 0.74 KCNH3 (0.50) ALDH1A1MAPTKMT2ASMN1; SMN2GAA
SCHEMBL8685601 0.74 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10ALOX15MAPT
Hydrochloric Acid SCHEMBL10664947 0.74 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10ALOX15MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040054178-A1 1,7, and 1,9-diarylpolymethine salts CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2004-03-18 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-20040054178-A1 1,7, and 1,9-diarylpolymethine salts NGLY1, QPCT, LPO ALDH1A1 2196/4885TSHR 3029/4885HSD17B10 1965/4885

“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.