SCHEMBL2163077

SCHEMBL2163077

COc1ccc2c(c1)nc1nc(-c3ccc(N)cc3)ccn12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAD51 Q06609 6/20 0.60
▸ FGFR1 P11362 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.42
▸ APP P05067 3/20 0.42
▸ POLB P06746 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TLR9 Q9NR96 1/20 0.41
▸ TLR7 Q9NYK1 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL2162641 0.93 RAD51 (0.51) RAD51ALDH1A1POLBSMN1; SMN2HPGD
SCHEMBL2164626 0.90 RAD51 (0.48) RAD51FGFR1ALDH1A1APPPOLB
SCHEMBL2162890 0.85 TLR9 (0.47) RAD51ALDH1A1APPPOLBSMN1; SMN2
SCHEMBL12403830 0.83 MAPT (0.45) RAD51APPSMN1; SMN2MEN1NPC1
SCHEMBL2162701 0.82 RAD51 (0.64) RAD51APPMEN1KMT2AMAPT
SCHEMBL2163017 0.82 MEN1 (0.45) RAD51ALDH1A1APPSMN1; SMN2HPGD
SCHEMBL2163050 0.81 RAD51 (0.57) RAD51APPMEN1NPC1KMT2A
SCHEMBL12323589 0.80 ALDH1A1 (0.40) RAD51ALDH1A1APPSMN1; SMN2MEN1
SCHEMBL2162709 0.79 ADORA2A (0.56) ALDH1A1POLBSMN1; SMN2HPGDNPC1
SCHEMBL2163616 0.78 RAD51 (0.55) RAD51ALDH1A1APPSMN1; SMN2MEN1

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
EP-2550255-B1 IMAGING AGENTS FOR DETECTING NEUROLOGICAL DISORDERS LILLY CO ELI (US) 2016-04-27 — — EP disclosed
EP-2550255-A1 IMAGING AGENTS FOR DETECTING NEUROLOGICAL DISORDERS Siemens Medical Solutions USA, Inc. (US) 2013-01-30 — — EP disclosed
WO-2011119565-A1 IMAGING AGENTS FOR DETECTING NEUROLOGICAL DISORDERS SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-09-29 — — WO 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 RAD51 1902/4885FGFR1 4345/4885ALDH1A1 3926/4885

“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.

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