SCHEMBL21149442

SCHEMBL21149442

CC1(C)c2ccccc2N(c2ccc3c(c2)Oc2ccccc2P3(=O)c2ccccc2)c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ITGB2 P05107 1/20 0.31
ICAM1 P05362 1/20 0.31
ITGAL P20701 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
SCHEMBL19318089 0.97
SCHEMBL24974079 0.94 MEN1 (0.32) MEN1NPC1USP2POLBMAPT
SCHEMBL19318158 0.91 MEN1 (0.31) MEN1NPC1USP2POLBMAPT
SCHEMBL21149443 0.90 MAPT (0.33) MEN1NPC1USP2POLBMAPT
SCHEMBL24974095 0.88 MEN1 (0.33) MEN1NPC1USP2POLBMAPT
SCHEMBL24974090 0.88 MEN1 (0.30) MEN1NPC1USP2POLBMAPT
SCHEMBL22063753 0.85 ITGB2 (0.34) MEN1NPC1USP2POLBMAPT
SCHEMBL19318088 0.84
SCHEMBL24974655 0.84
SCHEMBL24974654 0.83

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-11251380-B2 Organic electroluminescence device and polycyclic compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2022-02-15 US disclosed
US-20190214585-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-11 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 (2 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-11251380-B2 Organic electroluminescence device and polycyclic compound for organic electroluminescence device SIRT4, SIRT3, SIRT2 MEN1 2293/4885NPC1 2738/4885USP2 4597/4885
US-20190214585-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SIRT4, SIRT3, SIRT2 MEN1 2293/4885NPC1 2738/4885USP2 4597/4885

“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.