Sugi Predict

Sugi Predict / Compounds / SCHEMBL20582020

SCHEMBL20582020

SCHEMBL20582020

CC1(C)c2ccccc2-c2c(N)cc3ccccc3c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.36
▸ KEAP1 Q14145 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ CRHBP P24387 1/20 0.36
▸ CRHR2 Q13324 1/20 0.36
▸ NFE2L2 Q16236 1/20 0.36
▸ PDK2 Q15119 2/20 0.36
▸ MAPK1 P28482 2/20 0.35
▸ TYMS P04818 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ CASP1 P29466 2/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ DHFR P00374 1/20 0.35
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ MAPT P10636 3/20 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
SCHEMBL23288325 0.82 PRKCZ (0.40) ALDH1A1HPGDTSHRHSD17B10PDK2
SCHEMBL26380587 0.81 PDK2 (0.38) ALDH1A1HPGDTSHRHSD17B10PDK2
SCHEMBL22688546 0.81 CYP2D6 (0.37) ALDH1A1HPGDTSHRHSD17B10PDK2
SCHEMBL26399498 0.81 TRPM4 (0.42) ALDH1A1HPGDTSHRHSD17B10PDK2
SCHEMBL22000314 0.79 PDK2 (0.40) ALDH1A1KEAP1HPGDTSHRHSD17B10
SCHEMBL19152537 0.76 CAMK2D (0.36) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL26557664 0.75 CES1 (0.37) ALDH1A1HPGDTSHRHSD17B10PDK2
SCHEMBL23287618 0.75 LPL (0.36) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL23287619 0.75 ALDH1A1 (0.37) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25716215 0.74 ALDH1A1 (0.39) ALDH1A1KEAP1HPGDTSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11871657-B2 Compound for organic electric device, organic electric device using same, and electronic device thereof DUK SAN NEOLUX CO., LTD. 2024-01-09 — — US disclosed
US-20200152874-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD (KR) 2020-05-14 — — US disclosed
WO-2018225991-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2018-12-13 — — WO 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-20200152874-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF OR10J3, OR51E2, PIEZO1 ALDH1A1 1070/4885KEAP1 964/4885HPGD 2364/4885
US-11871657-B2 Compound for organic electric device, organic electric device using same, and electronic device thereof PIEZO1, KCNA5, KCNA1 ALDH1A1 187/4885KEAP1 744/4885HPGD 3692/4885

“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.