SCHEMBL25451

SCHEMBL25451

[c]1ccc2cc3cc4ccccc4cc3cc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 3/20 0.41
CYP3A4 P08684 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
HIF1A Q16665 2/20 0.41
ALOX15 P16050 1/20 0.41
HBB P68871 1/20 0.41
HPGD P15428 2/20 0.35
MAPT P10636 2/20 0.35
GLA P06280 1/20 0.35
ACHE P22303 1/20 0.35
CYP2A6 P11509 6/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
ALOX12 P18054 1/20 0.33
NQO2 P16083 1/20 0.33
CYP1A2 P05177 3/20 0.32
CA7 P43166 1/20 0.32

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
SCHEMBL21461252 1.00 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP3A4TDP1CASP1
SCHEMBL29101792 1.00 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP3A4TDP1CASP1
SCHEMBL5049192 1.00 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP3A4TDP1CASP1
SCHEMBL18529 0.97 ALDH1A1 (0.37) ALDH1A1HSD17B10CYP3A4TDP1CASP1
SCHEMBL1413199 0.92
SCHEMBL3241848 0.92
SCHEMBL1044899 0.92
SCHEMBL3241439 0.92
SCHEMBL559813 0.89
SCHEMBL70257 0.89

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 1952 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12041848-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2024-07-16 US claimed
CN-118026880-A Aryl amide compound, pharmaceutical composition containing same and application thereof 华东师范大学 2024-05-14 CN claimed
EP-3378853-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2024-04-17 EP claimed
CN-112441977-B Compound, application thereof and organic electroluminescent device comprising compound 北京鼎材科技有限公司 2024-03-19 CN claimed
US-11877509-B2 Organic light-emitting element LG CHEM, LTD. 2024-01-16 US claimed
US-20230225209-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS KUNSHAN GO-VISIONOX OPTO-ELECTRONICS CO., LTD (CN) 2023-07-13 US claimed
CN-115557879-A Compound and organic electronic device comprising the same 株式会社LG化学 2023-01-03 CN claimed
CN-110526896-B Luminescent material and application thereof 北京鼎材科技有限公司 2022-07-15 CN claimed
CN-108368077-B Heterocyclic compound and organic light-emitting device comprising same 株式会社LG化学 2022-07-05 CN claimed
US-RE49118-E1 Material for organic electroluminescence device and electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2022-06-28 US claimed
EP-1696015-A1 LIGHT-EMITTING MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, ORGANIC ELECTROLUMINESCENT DEVICE USING SAME, AND MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2006-08-30 EP claimed
WO-2006055085-A1 SEMICONDUCTORS CONTAINING TRANS-1,2-BIS(ACENYL)ETHYLENE COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-05-26 WO claimed
WO-2006055154-A1 ELECTROLUMINESCENT DEVICES CONTAINING TRANS-1,2-BIS(ACENYL)ETHYLENE COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-05-26 WO claimed
US-20060102893-A1 Semiconductors containing trans-1,2-bis(acenyl)ethylene compoounds 3M INNOVATIVE PROPERTIES COMPANY 2006-05-18 US claimed
US-20060105199-A1 Electroluminescent devices containing trans-1,2-bis(acenyl)ethylene compounds 3M INNOVATIVE PROPERTIES COMPANY 2006-05-18 US claimed
EP-1654248-A1 ACENE-THIOPHENE SEMICONDUCTORS 3M Innovative Properties Company (US) 2006-05-10 EP claimed
US-20060033086-A1 Depositing a gate electrode material on the substrate;depositing a gate dielectric on the gate electrode material;depositing an organic semiconductor layer comprising acene-thiophene compounds, providing a source electrode and a drain electrode contiguous to the organic semiconductor layer GERLACH CHRISTOPHER P 2006-02-16 US claimed
US-6998068-B2 Acene-thiophene semiconductors 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-02-14 US claimed
WO-2005019198-A1 ACENE-THIOPHENE SEMICONDUCTORS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-03-03 WO claimed
US-20050035333-A1 Acene-thiophene semiconductors 3M INNOVATIVE PROPERTIES COMPANY 2005-02-17 US claimed

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-12041848-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, NR2E3 ALDH1A1 242/4885HSD17B10 2591/4885CYP3A4 93/4885
US-11877509-B2 Organic light-emitting element CRY1, CRY2, NR2E3 ALDH1A1 567/4885HSD17B10 3335/4885CYP3A4 423/4885

“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.