SCHEMBL2164189

SCHEMBL2164189

Oc1ccc(-c2ccn3c(n2)nc2ccccc23)cc1F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.43
ESR2 Q92731 12/20 0.43
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B14 Q9BPX1 2/20 0.39
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
ADORA2A P29274 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35

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
SCHEMBL12402965 0.85 DPP4 (0.41) MEN1ALDH1A1MAPTKMT2AADORA2A
SCHEMBL2162664 0.85 RAD51 (0.40) ADORA2A
SCHEMBL12403623 0.82 ADORA2A (0.41) ADORA2A
SCHEMBL2163292 0.82 RAD51 (0.40) ADORA2A
SCHEMBL2163211 0.81 CYP11B2 (0.49) CYP11B1CYP11B2
SCHEMBL2162697 0.81 APP (0.37) MAPT
SCHEMBL2163811 0.81 ALDH1A1 (0.52) MEN1ALDH1A1MAPTKMT2A
Bromide SCHEMBL2163717 0.81 ADORA2A (0.41) ADORA2A
SCHEMBL12323630 0.81 ALDH1A1 (0.43) ALDH1A1KMT2AADORA2A
SCHEMBL2163042 0.81 ADORA2A (0.53) ESR1ESR2MEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550255-B1 IMAGING AGENTS FOR DETECTING NEUROLOGICAL DISORDERS LILLY CO ELI (US) 2016-04-27 EP disclosed
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-07-28 US disclosed
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-07-28 US disclosed
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-07-28 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-20110182812-A1 Imaging Agents for Detecting Neurological Disorders MAPT, APP, PSEN1 ESR1 4772/4885ESR2 3863/4885MEN1 335/4885

“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.