SCHEMBL6789185

SCHEMBL6789185

CN(C)c1cc(Nc2ccc(Br)cc2)nc(Nc2ccccc2)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.62
SLC2A1 P11166 1/20 0.54
ALDH1A1 P00352 1/20 0.50
TGM2 P21980 1/20 0.46
MAPT P10636 6/20 0.45
TP53 P04637 1/20 0.45
ADRB2 P07550 1/20 0.45
IGF1R P08069 2/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
PABPC1 P11940 1/20 0.43
CHEK1 O14757 1/20 0.43
IKBKB O14920 1/20 0.43
AURKA O14965 1/20 0.43
PDPK1 O15530 1/20 0.43
CHEK2 O96017 1/20 0.43
PRKCG P05129 1/20 0.43
CDK1 P06493 1/20 0.43

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
SCHEMBL6791894 0.91 TAAR1 (0.73) TAAR1SLC2A1ALDH1A1TGM2MAPT
SCHEMBL6789489 0.83 TAAR1 (0.59) TAAR1SLC2A1ALDH1A1TGM2MAPT
SCHEMBL6790627 0.82 TAAR1 (0.58) TAAR1SLC2A1ALDH1A1TGM2MAPT
SCHEMBL6790294 0.81 TAAR1 (0.59) TAAR1SLC2A1ALDH1A1TGM2MAPT
SCHEMBL2411151 0.80 TAAR1 (0.58) TAAR1SLC2A1ALDH1A1TGM2MAPT
SCHEMBL6784490 0.80 TAAR1 (0.59) TAAR1SLC2A1ALDH1A1TGM2MAPT
SCHEMBL8084560 0.80 TAAR1 (0.59) TAAR1SLC2A1ALDH1A1TGM2MAPT
SCHEMBL3247948 0.78 TAAR1 (0.56) TAAR1SLC2A1MAPTTP53NPC1
SCHEMBL10144336 0.76 TAAR1 (0.53) TAAR1SLC2A1ALDH1A1MAPTTP53
SCHEMBL3244058 0.76 TAAR1 (0.69) TAAR1SLC2A1ALDH1A1TGM2MAPT

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-20040127502-A1 Use of GAL3 antagonist for treatment of depression SYNAPTIC PHARMACEUTICAL CORPORATION 2004-07-01 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-20040127502-A1 Use of GAL3 antagonist for treatment of depression GALR3, GALR2, GALR1 TAAR1 270/4885SLC2A1 1700/4885ALDH1A1 2098/4885

“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.