SCHEMBL3209524

SCHEMBL3209524

O=C1CC=C(c2c[nH]c3cccnc23)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.40
GSK3B P49841 2/20 0.40
KDR P35968 1/20 0.40
PARP1 P09874 3/20 0.37
KDM4E B2RXH2 4/20 0.37
HSD17B10 Q99714 4/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
ALOX15 P16050 2/20 0.37
HTR2C P28335 2/20 0.37
DRD2 P14416 1/20 0.37
PIM1 P11309 1/20 0.36
CDK7 P50613 1/20 0.36
CDK9 P50750 1/20 0.36
MEN1 O00255 2/20 0.36
CYP2C9 P11712 2/20 0.36
HPGD P15428 2/20 0.36
CYP2C19 P33261 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL9213561 0.78 DRD2 (0.59) KDM4EHSD17B10ALDH1A1MAPTALOX15
SCHEMBL9697101 0.76 KDM4E (0.61) KDM4EHSD17B10ALDH1A1MAPTALOX15
Ethylene SCHEMBL7259929 0.75 DRD2 (0.56) KDM4EHSD17B10ALDH1A1MAPTALOX15
SCHEMBL23536642 0.75 PIM1 (0.42) FLT3GSK3BKDRKDM4EHSD17B10
SCHEMBL3627711 0.73 SLC6A4 (0.64) KDM4EHSD17B10ALOX15HTR1ASLC6A4
SCHEMBL16801705 0.71 PDE10A (0.49) FLT3GSK3BKDRMAPTPIM1
SCHEMBL25244381 0.70 HTR2A (0.56) FLT3GSK3BKDRKDM4EHSD17B10
SCHEMBL6634772 0.70 SLC6A4 (0.59) KDM4EHTR2CDRD2HTR1ASLC6A4
SCHEMBL3227327 0.70 SLC6A4 (0.66) FLT3GSK3BKDRKDM4EHSD17B10
SCHEMBL3227382 0.70 FLT3 (0.36) FLT3GSK3BKDRPARP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010024980-A1 4'-AMINO CYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-03-04 WO disclosed
WO-2010024980-A1 4'-AMINO CYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-03-04 WO disclosed
US-20100056491-A1 4'-AMINO CYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-03-04 US disclosed
US-20100056491-A1 4'-AMINO CYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-03-04 US disclosed
US-20100056491-A1 4'-AMINO CYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-03-04 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-20100056491-A1 4'-AMINO CYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY HTR6, HTR4, HTR3B FLT3 2071/4885GSK3B 2327/4885KDR 633/4885

“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.