SCHEMBL8434860

SCHEMBL8434860

Clc1cccc(-c2cccc3ccccc23)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.50
CYP1A2 P05177 7/20 0.49
CYP1B1 Q16678 5/20 0.49
CYP1A1 P04798 4/20 0.48
FADS1 O60427 1/20 0.47
MCL1 Q07820 2/20 0.46
ACMSD Q8TDX5 1/20 0.46
IDO1 P14902 1/20 0.45
NUDT1 P36639 2/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
CYP2A6 P11509 1/20 0.45
DHFR P00374 1/20 0.45
NR1I3 Q14994 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL25681090 0.98 SERPINE1 (0.49) SERPINE1CYP1A2CYP1B1CYP1A1FADS1
SCHEMBL25681075 0.96 CYP1A2 (0.50) SERPINE1CYP1A2CYP1B1CYP1A1FADS1
SCHEMBL23238902 0.96 SERPINE1 (0.48) SERPINE1CYP1A2CYP1B1CYP1A1FADS1
SCHEMBL26279852 0.91 CYP1A2 (0.47) SERPINE1CYP1A2CYP1B1CYP1A1FADS1
SCHEMBL27254523 0.90 CYP1A2 (0.46) SERPINE1CYP1A2CYP1B1CYP1A1FADS1
SCHEMBL25125118 0.88 ALDH1A1 (0.46) SERPINE1CYP1A2CYP1B1CYP1A1FADS1
SCHEMBL25681057 0.88 NPC1 (0.48) NUDT1ADORA2AADORA1CYP2A6DHFR
SCHEMBL31229563 0.87 CYP1A2 (0.43) SERPINE1CYP1A2CYP1B1CYP1A1FADS1
SCHEMBL25681064 0.87 CYP2A6 (0.50) SERPINE1CYP1A2CYP1B1CYP1A1NUDT1
SCHEMBL31651446 0.86 CYP1A2 (0.46) SERPINE1CYP1A2CYP1B1CYP1A1FADS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230416201-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND LIGHT-RECEIVING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2023-12-28 US disclosed
CN-117209415-A Organic compound, light-emitting device, and light-receiving device 株式会社半导体能源研究所 2023-12-12 CN disclosed
US-11690292-B2 Organic electronic element comprising a compound for organic electronic element and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-06-27 US disclosed
US-11690292-B2 Organic electronic element comprising a compound for organic electronic element and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-06-27 US disclosed
US-20230129535-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING A COMPOUND FOR ORGANIC ELECTRONIC ELEMENT AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-04-27 US disclosed
US-20230129535-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING A COMPOUND FOR ORGANIC ELECTRONIC ELEMENT AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-04-27 US disclosed
US-5945422-A ANTICANCER AGENTS; ATHEROSCLEROSIS; RESTENOSIS; PSORIASIS WARNER-LAMBERT COMPANY (US) 1999-08-31 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-20230416201-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND LIGHT-RECEIVING DEVICE CRY1, CRY2, NR2E3 SERPINE1 3530/4885CYP1A2 168/4885CYP1B1 141/4885
US-11690292-B2 Organic electronic element comprising a compound for organic electronic element and an electronic device thereof ESR1, EML4, ORAI2 SERPINE1 3241/4885CYP1A2 354/4885CYP1B1 1090/4885
US-20230129535-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING A COMPOUND FOR ORGANIC ELECTRONIC ELEMENT AND AN ELECTRONIC DEVICE THEREOF ESR1, EML4, ORAI2 SERPINE1 3241/4885CYP1A2 354/4885CYP1B1 1090/4885

“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.