SCHEMBL9535269

SCHEMBL9535269

N=C(N)N(CCc1c[nH]cn1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ADRA2C P18825 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
SCHEMBL8197027 0.81 TP53 (0.39) MEN1KMT2AADRA2C
SCHEMBL7774837 0.80 TP53 (0.44) MEN1KMT2AADRA2C
SCHEMBL9828326 0.78 HRH4 (0.33)
Hydrochloric Acid SCHEMBL9827568 0.77 GRIN2D (0.33)
SCHEMBL8741856 0.75 KMT2A (0.50) MEN1KMT2AADRA2C
SCHEMBL7433406 0.75 PTGDR2 (0.37)
SCHEMBL7987124 0.74 ADRA2C (0.38) MEN1KMT2AADRA2C
SCHEMBL7287544 0.74 HRH1 (0.41)
SCHEMBL9828576 0.74 HRH4 (0.39) KMT2AADRA2C
Hydrochloric Acid SCHEMBL7428983 0.74 PTGDR2 (0.36)

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
EP-0573542-A1 IMIDAZOLE-DERIVATIVES HAVING AGONISTIC OR ANTAGONISTIC ACTIVITY ON THE HISTAMINE H 3?-RECEPTOR. SEED CAPITAL INVESTMENTS (NL) 1993-12-15 EP disclosed