SCHEMBL8091908

SCHEMBL8091908

CCCCN1CNc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 1/20 0.41
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
DRD2 P14416 2/20 0.38
DRD3 P35462 2/20 0.38
HPGD P15428 2/20 0.38
KDM1A O60341 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
DRD4 P21917 1/20 0.38
ALDH1A1 P00352 2/20 0.37
ALDH2 P05091 1/20 0.37
ALDH3A1 P30838 1/20 0.37

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
SCHEMBL9038711 0.93 CES1 (0.44) BRPF1LMNAMEN1KMT2ACYP1A2
SCHEMBL7854100 0.89 MEN1 (0.44) BRPF1LMNAGAAMEN1KMT2A
SCHEMBL6450576 0.85 BRPF1 (0.44) BRPF1LMNAGAAMEN1KMT2A
SCHEMBL30277548 0.83 BRPF1 (0.38) BRPF1LMNAGAAMEN1KMT2A
SCHEMBL14185922 0.82 SLC6A2 (0.53) BRPF1MEN1KMT2ACYP1A2CYP2D6
SCHEMBL9868798 0.82 GRIA2 (0.44) BRPF1GAAMEN1KMT2AALDH1A1
SCHEMBL19949967 0.79 MEN1 (0.46) BRPF1LMNAMEN1KMT2ACYP1A2
SCHEMBL10680826 0.79 BRPF1 (0.40) BRPF1LMNAGAAMEN1KMT2A
SCHEMBL9436144 0.79 ALDH1A1 (0.42) BRPF1LMNAGAAMEN1KMT2A
SCHEMBL28176871 0.78 BRPF1 (0.40) BRPF1LMNAGAACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103193761-B 2-phenyl-6-azolylpyridine ligand and group VIII transition metal complex formed by same JI YUN (CN) 2015-12-02 CN disclosed
US-8889872-B2 Bisazole-based compound and group VIII transition metal complex NATIONAL TSING HUA UNIVERSITY (TW) 2014-11-18 US disclosed
US-8580961-B2 2-phenyl-6-azolylpyridine-based ligand and group VIII transition metal complex NATIONAL TSING HUA UNIVERSITY (TW) 2013-11-12 US disclosed
US-20130296567-A1 BISAZOLE-BASED COMPOUND AND GROUP VIII TRANSITION METAL COMPLEX NATIONAL TSING HUA UNIVERSITY (TW) 2013-11-07 US disclosed
CN-103193761-A 2-phenyl-6-azolylpyridine ligand and group VIII transition metal complex formed by same CHI YUN 2013-07-10 CN disclosed
US-20130018189-A1 2-PHENYL-6-AZOLYLPYRIDINE-BASED LIGAND AND GROUP VIII TRANSITION METAL COMPLEX NATIONAL TSING HUA UNIVERSITY (TW) 2013-01-17 US disclosed
WO-2009035684-A1 SPIROCYCLIC AMINOQUINOLONES AS GSK-3 INHIBITORS ACTIVX BIOSCIENCES, INC. (US) 2009-03-19 WO 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 (2 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-20130296567-A1 BISAZOLE-BASED COMPOUND AND GROUP VIII TRANSITION METAL COMPLEX LAS1L, MLKL, HBS1L BRPF1 2447/4885LMNA 902/4885GAA 4440/4885
US-20130018189-A1 2-PHENYL-6-AZOLYLPYRIDINE-BASED LIGAND AND GROUP VIII TRANSITION METAL COMPLEX C1S, H1-10, INTS6 BRPF1 3224/4885LMNA 3649/4885GAA 4774/4885

“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.