SCHEMBL6500147

SCHEMBL6500147

CC1(C)C/C(=N\NC(=N)N)c2c([nH]c3ccc(F)cc23)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2 P11137 1/20 0.36
BAZ2B Q9UIF8 1/20 0.35
PARP1 P09874 2/20 0.34
PARP2 Q9UGN5 1/20 0.34
PADI4 Q9UM07 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
BUB1 O43683 5/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR7 P34969 1/20 0.32
HTR6 P50406 1/20 0.32
F2 P00734 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
JAK2 O60674 2/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PARP3 Q9Y6F1 1/20 0.32

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
SCHEMBL6500149 1.00 MAP2 (0.36) MAP2BAZ2BPARP1PARP2PADI4
SCHEMBL6488072 0.89 ALDH1A1 (0.35) BAZ2BMEN1ALDH1A1MAPTKMT2A
SCHEMBL6488069 0.89 ALDH1A1 (0.35) BAZ2BMEN1ALDH1A1MAPTKMT2A
SCHEMBL6487432 0.88 SIRT1 (0.37) MAP2BAZ2BMEN1ALDH1A1MAPT
SCHEMBL6487436 0.88 SIRT1 (0.37) MAP2BAZ2BMEN1ALDH1A1MAPT
SCHEMBL6491884 0.88 SIRT1 (0.37) BAZ2BMEN1ALDH1A1MAPTKMT2A
SCHEMBL6491882 0.88 SIRT1 (0.37) BAZ2BMEN1ALDH1A1MAPTKMT2A
SCHEMBL6494579 0.87 MAPT (0.38) MEN1ALDH1A1MAPTKMT2ABUB1
SCHEMBL6494583 0.87 MAPT (0.38) MEN1ALDH1A1MAPTKMT2ABUB1
SCHEMBL6490196 0.85 BUB1 (0.37) MAPTKMT2ABUB1

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-6951881-B2 (1-substituted-indol-3-yl) alkylidenehydrazinecarboximidamide derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2005-10-04 US disclosed
US-20030232843-A1 (1-Substituted-indol-3-yl) alkylidenehydrazinecarboximidamide derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2003-12-18 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-20030232843-A1 (1-Substituted-indol-3-yl) alkylidenehydrazinecarboximidamide derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR1A MAP2 1097/4885BAZ2B 3444/4885PARP1 2971/4885

“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.