SCHEMBL23447235

SCHEMBL23447235

Cc1cc(C(C)(C)C)ccc1Nc1coc2ccc(C(C)(C)C)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK1D P48730 1/20 0.37
▸ LMNA P02545 4/20 0.37
▸ ALDH1A1 P00352 5/20 0.36
▸ HTT P42858 2/20 0.36
▸ PON1 P27169 1/20 0.35
▸ FGFR2 P21802 1/20 0.35
▸ TSHR P16473 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NLRP3 Q96P20 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ NR1H4 Q96RI1 1/20 0.32
▸ KIF11 P52732 1/20 0.32
▸ RAPGEF4 Q8WZA2 1/20 0.32
▸ AKR1C3 P42330 1/20 0.31
▸ AKR1C2 P52895 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ AR P10275 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
SCHEMBL29911045 1.00 CSNK1D (0.37) CSNK1DLMNAALDH1A1HTTPON1
SCHEMBL24779288 0.88 RAPGEF4 (0.37) CSNK1DLMNAALDH1A1HTTPON1
SCHEMBL23450954 0.86 AKR1C3 (0.40) CSNK1DLMNAALDH1A1HTTPON1
SCHEMBL30872231 0.86 AKR1C3 (0.40) CSNK1DLMNAALDH1A1HTTPON1
SCHEMBL30679840 0.82 NPC1 (0.36) LMNAALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL28700964 0.82 NPC1 (0.36) LMNAALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL24509571 0.82 AKR1C3 (0.37) LMNAALDH1A1HTTPON1TSHR
SCHEMBL30719048 0.81 CSNK1D (0.47) CSNK1DLMNAALDH1A1FGFR2TSHR
SCHEMBL23927543 0.81 CSNK1D (0.47) CSNK1DLMNAALDH1A1FGFR2TSHR
SCHEMBL13561307 0.80 PON1 (0.41) ALDH1A1PON1TSHRMAPTKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11780856-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2023-10-10 — — US disclosed
US-11780856-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2023-10-10 — — US disclosed
CN-113348172-B Compound and organic light emitting device including the same 株式会社LG化学 2022-10-11 — — CN disclosed
CN-113348172-A Compound and organic light emitting device including the same 株式会社LG化学 2021-09-03 — — CN disclosed
WO-2021107681-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-06-03 — — 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 (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-11780856-B2 Compound and organic light-emitting device comprising same CRY1, CRY2, LEF1 CSNK1D 1787/4885LMNA 2441/4885ALDH1A1 26/4885

“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.

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