SCHEMBL21397930

SCHEMBL21397930

c1ccc2c(c1)-c1ccccc1C21c2cc3c(cc2-c2cc4c5c6ccccc6ccc5n(-c5ccc6c(c5)sc5ccccc56)c4cc21)c1c2ccccc2ccc1n3-c1ccc2c(c1)sc1ccccc12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL20199646 0.93
SCHEMBL26476606 0.91 ALDH1A1 (0.30) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23184168 0.89
SCHEMBL20199763 0.89
SCHEMBL23184850 0.89
SCHEMBL20199601 0.88
SCHEMBL23739063 0.88
SCHEMBL21125560 0.86 ALDH1A1 (0.31) ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL23738834 0.86
SCHEMBL26476604 0.85

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-20190292210-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-26 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-20190292210-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES AP2M1, MCU, AP3M1 ALDH1A1 2989/4885MAPT 1256/4885HPGD 4024/4885

“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.