SCHEMBL6359088

SCHEMBL6359088

Cc1ccc(Nc2cc(N(C)C)nc([C@@]3(C)CNC[C@@H](C)O3)n2)cc1Br

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.35
HPGD P15428 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL6359089 0.71 PIK3CA (0.43) ROCK2HPGDL3MBTL1
SCHEMBL6360442 0.60 CASP1 (0.43) L3MBTL1
SCHEMBL13963092 0.57 RAB9A (0.61) ROCK2HPGDL3MBTL1
SCHEMBL8524757 0.55 MEN1 (0.44) HPGDL3MBTL1
SCHEMBL2411151 0.55 TAAR1 (0.58) L3MBTL1
SCHEMBL8253294 0.54 NPSR1 (0.43) ROCK2HPGD
SCHEMBL6784490 0.54 TAAR1 (0.59)
SCHEMBL8084560 0.54 TAAR1 (0.59)
SCHEMBL2309841 0.54 RAB9A (0.48) HPGDL3MBTL1
SCHEMBL18162511 0.53 LMNA (0.53) ROCK2

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-6936607-B2 2,4,6-Triaminopyrimidines for the treatment of depression and/or anxiety H. LUNOBECK A/S (DK) 2005-08-30 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 ROCK2 4104/4885HPGD 2516/4885L3MBTL1 3491/4885

“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.