SCHEMBL2604950

SCHEMBL2604950

COc1ccc(/C=C/c2cccc(/C=C/c3ccc(OC)c4ccccc34)n2)c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
LMNA P02545 2/20 0.61
APP P05067 7/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CHAT P28329 1/20 0.49
CAPN1 P07384 1/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
ABCB1 P08183 1/20 0.48
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 1/20 0.44
DHFR P00374 1/20 0.44

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
SCHEMBL11671491 0.83 MAPT (0.60) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL11670549 0.83 MAPT (0.60) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL2604952 0.80 MAPT (0.79) MAPTLMNAAPPMEN1KMT2A
SCHEMBL7915395 0.79 MAPT (0.63) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL7915398 0.79 MAPT (0.63) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL2604948 0.79 LMNA (0.68) MAPTLMNAAPPCHATCAPN1
SCHEMBL2604932 0.78 LMNA (0.77) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL11819366 0.78 MAPT (0.61) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL11821979 0.78 MAPT (0.61) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL2604937 0.76 MAPT (1.00) MAPTLMNAMEN1KMT2AHPGD

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
US-8158380-B2 Imaging agents for protein misfolding NEW YORK UNIVERSITY (US) 2012-04-17 US disclosed
US-8158380-B2 Imaging agents for protein misfolding NEW YORK UNIVERSITY (US) 2012-04-17 US disclosed
US-20100279340-A1 Imaging agents for protein misfolding NYU (US) 2010-11-04 US disclosed
US-20100279340-A1 Imaging agents for protein misfolding NYU (US) 2010-11-04 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-20100279340-A1 Imaging agents for protein misfolding APBA1, APP, SPG11 MAPT 4/4885LMNA 1999/4885APP 2/4885

“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.