SCHEMBL20172773

SCHEMBL20172773

Cc1ccc(N(C)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.68
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 2/20 0.41
TYR P14679 1/20 0.41
HCRTR2 O43614 1/20 0.40
ACHE P22303 2/20 0.39
BCHE P06276 1/20 0.39
HSD17B10 Q99714 1/20 0.38
KCNH2 Q12809 1/20 0.37
SLC2A1 P11166 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CES1 P23141 1/20 0.36
HSD11B1 P28845 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
KIF11 P52732 1/20 0.35
KDM4C Q9H3R0 1/20 0.35

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
SCHEMBL1134090 0.91 TSHR (0.50) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL13197654 0.89 TSHR (0.54) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL13367482 0.85 TSHR (0.48) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL20650361 0.84 TSHR (0.65) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL24145271 0.84 KIF11 (0.52) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL13322018 0.84 TSHR (0.71) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL11994079 0.84 TSHR (0.71) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL16682899 0.84 TSHR (0.71) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL19996361 0.84 TSHR (0.71) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL22083898 0.83 ALDH1A1 (0.67) TSHRALDH1A1MAPTRAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230140877-A1 Novel Compound and Organic Light Emitting Device Comprising the Same LG CHEM, LTD. (KR) 2023-05-11 US disclosed
US-20230140877-A1 Novel Compound and Organic Light Emitting Device Comprising the Same LG CHEM, LTD. (KR) 2023-05-11 US disclosed
US-11584753-B2 Bisbenzofuran-fused 2,8-diaminoindeno[1,2-b]fluorene derivatives and related compounds as materials for organic electroluminescent devices (OLED) MERCK PATENT GMBH (DE) 2023-02-21 US disclosed
CN-111233700-B Diimine palladium complex, ligand thereof, preparation method and application 中国科学技术大学 2021-12-14 CN disclosed
EP-3544984-B1 BISBENZOFURAN-FUSED 2,8-DIAMINOINDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) MERCK PATENT GMBH (DE) 2020-12-23 EP disclosed
CN-111233700-A Diimine palladium complex, ligand thereof, preparation method and application 中国科学技术大学 2020-06-05 CN disclosed
US-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 US disclosed
US-20190315764-A1 BISBENZOFURAN-FUSED 2,8-DIAMINOINDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) MERCK PATENT GMBH (DE) 2019-10-17 US disclosed
US-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2019-05-23 US disclosed
WO-2018095888-A1 BISBENZOFURAN-FUSED 2,8-DIAMINOINDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) MERCK PATENT GMBH (DE) 2018-05-31 WO disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 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 (6 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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 TSHR 3775/4885ALDH1A1 87/4885MAPT 754/4885
US-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ETV6, ESR1 TSHR 4256/4885ALDH1A1 1103/4885MAPT 1486/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 TSHR 3775/4885ALDH1A1 87/4885MAPT 754/4885
US-20190315764-A1 BISBENZOFURAN-FUSED 2,8-DIAMINOINDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) OCIAD1, OCIAD2, AOC1 TSHR 4385/4885ALDH1A1 99/4885MAPT 2355/4885
US-11584753-B2 Bisbenzofuran-fused 2,8-diaminoindeno[1,2-b]fluorene derivatives and related compounds as materials for organic electroluminescent devices (OLED) OCIAD1, OCIAD2, AOC1 TSHR 4385/4885ALDH1A1 99/4885MAPT 2355/4885
US-20230140877-A1 Novel Compound and Organic Light Emitting Device Comprising the Same CRY2, CRY1, GLI1 TSHR 4136/4885ALDH1A1 105/4885MAPT 605/4885

“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.