SCHEMBL21473074

SCHEMBL21473074

c1ccc(-c2ccc(-c3cccc4c5ccc6c7ccccc7c7cncc8c7c6c5n8c34)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.38
DYRK1A Q13627 1/20 0.32
IMPDH2 P12268 1/20 0.32
CYP17A1 P05093 2/20 0.31
CYP1A2 P05177 2/20 0.31
CDK4 P11802 1/20 0.30
CCND1 P24385 1/20 0.30
METAP2 P50579 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
SCHEMBL21473093 0.89 TNF (0.42) TNFDYRK1AIMPDH2CYP17A1CYP1A2
SCHEMBL21473094 0.89 TNF (0.42) TNFDYRK1AIMPDH2CYP17A1CYP1A2
SCHEMBL21461880 0.86 MAPK14 (0.34) CDK4CCND1
SCHEMBL21472987 0.83 CDK4 (0.35) CYP1A2CDK4CCND1
SCHEMBL21473101 0.81 MEN1 (0.34) CDK4CCND1
SCHEMBL21472988 0.79 PRKDC (0.33) CDK4CCND1
SCHEMBL21473035 0.78 GABRP (0.32)
SCHEMBL21473107 0.78 PLG (0.33) CDK4CCND1
SCHEMBL21473049 0.75 CCNA2 (0.37) TNFDYRK1ACDK4CCND1
SCHEMBL21472969 0.75 ALDH1A1 (0.31)

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-20190315759-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2019-10-17 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-20190315759-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES OSBP, OSBP2, OSBPL3 TNF 4748/4885DYRK1A 4816/4885IMPDH2 2131/4885

“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.