SCHEMBL3209570

SCHEMBL3209570

Cc1cc2c(cc1C)C1(c3ccccc3C2O)c2ccccc2N(c2ccccc2)c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ADAMTS5 Q9UNA0 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL20284478 0.88 ALDH1A1 (0.35) MAPTADAMTS5EGLN1
SCHEMBL3197044 0.87 PDK2 (0.33) MAPTKDM4EADAMTS5EGLN1
SCHEMBL3205939 0.81 PDK2 (0.34) NPC1RAB9AKDM4EEGLN1
SCHEMBL3186198 0.75 ESR1 (0.36) NPC1MAPTRAB9AKDM4EADAMTS5
SCHEMBL3076018 0.74 ALDH1A1 (0.38) MAPTKDM4EADAMTS5EGLN1
SCHEMBL20202064 0.73 ALDH1A1 (0.44) ADAMTS5EGLN1
SCHEMBL10037388 0.72 KDM4E (0.34) MAPTKDM4E
SCHEMBL2754782 0.70 KDM4E (0.42) MAPTKDM4EADAMTS5EGLN1
SCHEMBL3227987 0.70 EGLN1 (0.33) ADAMTS5EGLN1
SCHEMBL29156687 0.70 ADAMTS5 (0.39) MAPTADAMTS5EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120001537-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-01-05 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-20120001537-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME OR10J3, ORC3, PIEZO1 NPC1 2813/4885MAPT 1887/4885RAB9A 1473/4885

“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.