SCHEMBL8253248

SCHEMBL8253248

COc1cccc(Nc2cc(N(C)C)nc(N3CCN(c4ccccc4F)CC3)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GALR2 O43603 7/20 0.55
GALR1 P47211 6/20 0.55
TSHR P16473 4/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
KDM4E B2RXH2 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
HTR2C P28335 4/20 0.44
HTR2A P28223 2/20 0.44
SCN9A Q15858 1/20 0.42
GBA1 P04062 1/20 0.41

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
SCHEMBL8256921 0.89 GALR2 (0.56) GALR2GALR1MAPK1POLBMAPT
SCHEMBL6784994 0.88 GALR2 (0.52) GALR2GALR1HTR2CHTR2ASCN9A
SCHEMBL8247745 0.87 GALR2 (0.44) GALR2GALR1TSHRALDH1A1LMNA
SCHEMBL8263323 0.86 GALR2 (0.59) GALR2GALR1POLBMAPTHTR2C
SCHEMBL8254470 0.83 GALR2 (0.42) GALR2GALR1TSHRALDH1A1KDM4E
SCHEMBL3242747 0.83 GALR2 (0.60) GALR2GALR1MAPK1MAPTHTR2C
SCHEMBL8256643 0.83 MAPT (0.48) GALR2GALR1TSHRALDH1A1LMNA
SCHEMBL3247288 0.83 GALR1 (0.55) GALR2GALR1ALDH1A1LMNAMAPT
SCHEMBL8256940 0.82 MAPT (0.43) GALR2GALR1TSHRALDH1A1LMNA
SCHEMBL6797121 0.82 GALR2 (0.54) GALR2GALR1TSHRALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040082587-A1 2,4,6-Triaminopyrimidines for the treatment of depression and/or anxiety H. LUNDBECK A/S (DK) 2004-04-29 US disclosed
US-20040082587-A1 2,4,6-Triaminopyrimidines for the treatment of depression and/or anxiety H. LUNDBECK A/S (DK) 2004-04-29 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-20040082587-A1 2,4,6-Triaminopyrimidines for the treatment of depression and/or anxiety GALR3, GALR2, GALR1 GALR2 2/4885GALR1 3/4885TSHR 105/4885

“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.