SCHEMBL21983018

SCHEMBL21983018

c1ccc(-c2cc3c4c(c2)Oc2cccc5c2B4c2c(cccc2O3)O5)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
MAOA P21397 2/20 0.34
CYP1A2 P05177 1/20 0.33
AHR P35869 2/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
NTSR1 P30989 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
EGFR P00533 1/20 0.32
MGLL Q99685 1/20 0.31
ALOX5 P09917 2/20 0.31
MAOB P27338 1/20 0.31
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
PTGS2 P35354 1/20 0.31
ELANE P08246 1/20 0.31

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
SCHEMBL21302915 1.00 ALDH1A1 (0.36) ALDH1A1MAOACYP1A2AHRCRHBP
SCHEMBL21983246 0.94 ALDH1A1 (0.41) ALDH1A1MAOACYP1A2CRHBPCRHR2
SCHEMBL21982992 0.92 CYP1A2 (0.41) ALDH1A1CYP1A2CRHBPCRHR2EGFR
SCHEMBL21983181 0.92 AHR (0.31) AHR
SCHEMBL24677329 0.92 AHR (0.33) MAOAAHRALOX5MAOB
SCHEMBL21793762 0.85 ALDH1A1 (0.33) ALDH1A1CYP1A2AHRCRHBPCRHR2
SCHEMBL20908597 0.84 FAAH (0.33) ALDH1A1MGLL
SCHEMBL19938322 0.84 FAAH (0.33) ALDH1A1MGLL
SCHEMBL21414507 0.84 KMO (0.33) ALDH1A1MAOAEGFRMGLLCA12
SCHEMBL16889443 0.84 KMO (0.33) ALDH1A1MAOAEGFRMGLLCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230337525-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-19 US disclosed
US-10651395-B2 Organic electroluminescent element, display device, and illumination device Konica Minolta, Inc. (JP) 2020-05-12 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-20230337525-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OXER1 ALDH1A1 60/4885MAOA 380/4885CYP1A2 257/4885

“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.