Sugi Predict

Sugi Predict / Compounds / SCHEMBL22097079

SCHEMBL22097079

SCHEMBL22097079

CC(C)(C)c1nc(C(C)(C)C)c2ccc3ccccc3c2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MAOA P21397 1/20 0.40
▸ HPRT1 P00492 1/20 0.39
▸ TSHR P16473 4/20 0.37
▸ HSD17B10 Q99714 3/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ CYP2A6 P11509 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ CYP3A4 P08684 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ ATM Q13315 2/20 0.34
▸ HIF1A Q16665 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ CYP1A2 P05177 2/20 0.34

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
SCHEMBL25878190 0.83 L3MBTL1 (0.46) L3MBTL1MAPTMAOAHPRT1TSHR
SCHEMBL22249623 0.81 L3MBTL1 (0.41) L3MBTL1MAPTMAOAHPRT1TSHR
SCHEMBL24626814 0.79 MAPT (0.40) L3MBTL1MAPTMAOAHPRT1TSHR
SCHEMBL19161960 0.79 MAOA (0.40) L3MBTL1MAPTMAOAHPRT1TSHR
SCHEMBL19162668 0.76 MAOA (0.38) L3MBTL1MAPTMAOAHPRT1ALDH1A1
SCHEMBL24604812 0.76 MAPT (0.39) L3MBTL1MAPTMAOAHPRT1TSHR
SCHEMBL19162667 0.75 MAPT (0.40) L3MBTL1MAPTMAOAALDH1A1RAB9A
SCHEMBL25817326 0.75 TYMS (0.46) L3MBTL1MAPTHPRT1TSHRHSD17B10
SCHEMBL22960296 0.74 KDM4E (0.45) L3MBTL1MAPTHSD17B10TDP1ALDH1A1
SCHEMBL20089417 0.74 L3MBTL1 (0.47) L3MBTL1MAPTMAOAHPRT1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-06 — — US disclosed
US-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-06 — — US disclosed
US-11236075-B2 Organic compound and organic electroluminescence device using the same LUMINESCENCE TECHNOLOGY CORP. (TW) 2022-02-01 — — US disclosed
US-20200190065-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2020-06-18 — — 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 (3 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-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME OR10J3, AOC2, EPCAM L3MBTL1 1420/4885MAPT 1654/4885MAOA 191/4885
US-11236075-B2 Organic compound and organic electroluminescence device using the same ICMT, OR10J3, PIEZO1 L3MBTL1 179/4885MAPT 508/4885MAOA 679/4885
US-20200190065-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME ICMT, OR10J3, PIEZO1 L3MBTL1 179/4885MAPT 508/4885MAOA 679/4885

“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.