SCHEMBL8253239

SCHEMBL8253239

CN(C)c1cc(Nc2ccc(SC(F)(F)F)c(Cl)c2)nc(N2CCN(c3ccccc3Cl)CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GALR2 O43603 9/20 0.36
GALR1 P47211 7/20 0.36
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
HTR7 P34969 1/20 0.36
HTR6 P50406 1/20 0.36
LMNA P02545 1/20 0.35
ROCK2 O75116 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
TNK2 Q07912 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL3240505 0.88 MAPT (0.39) POLBMAPTNPSR1GALR2GALR1
SCHEMBL8253255 0.87 LMNA (0.41) POLBMAPTNPSR1GALR2GALR1
SCHEMBL8256650 0.85 MAPT (0.45) POLBMAPTNPSR1GALR2GALR1
SCHEMBL8254467 0.82 MAPT (0.48) POLBMAPTNPSR1GALR2GALR1
SCHEMBL8253195 0.81 MAPT (0.48) POLBMAPTNPSR1GALR2GALR1
SCHEMBL8256940 0.80 MAPT (0.43) POLBMAPTNPSR1GALR2GALR1
SCHEMBL8253243 0.79 MAPT (0.39) POLBMAPTNPSR1GALR2GALR1
SCHEMBL8256921 0.77 GALR2 (0.56) POLBMAPTGALR2GALR1HTR2A
SCHEMBL13596142 0.77 GALR1 (0.43) POLBMAPTGALR2GALR1LMNA
SCHEMBL8254469 0.77 SMN1; SMN2 (0.40) POLBMAPTNPSR1GALR2GALR1

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 POLB 2882/4885MAPT 2638/4885NPSR1 87/4885

“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.