Sugi Predict

Sugi Predict / Compounds / SCHEMBL8512875

SCHEMBL8512875

SCHEMBL8512875

Brc1cccc(-n2c(-c3ccccc3)nc3ccccc32)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.58
▸ ESR2 Q92731 1/20 0.58
▸ MAPK1 P28482 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ MAPT P10636 4/20 0.51
▸ HDAC1 Q13547 2/20 0.51
▸ HDAC8 Q9BY41 2/20 0.51
▸ HDAC6 Q9UBN7 2/20 0.51
▸ LMNA P02545 3/20 0.50
▸ TSHR P16473 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ DCTPP1 Q9H773 1/20 0.50
▸ GAA P10253 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ GRIA1 P42261 1/20 0.47
▸ CACNG8 Q8WXS5 1/20 0.47
▸ CACNG2 Q9Y698 1/20 0.47
▸ PLAUR Q03405 1/20 0.46
▸ ABCG2 Q9UNQ0 1/20 0.45

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
SCHEMBL338639 0.91 ESR1 (0.58) ESR1ESR2MAPK1HTTMAPT
SCHEMBL16116627 0.90 ESR1 (0.58) ESR1ESR2MAPK1HTTMAPT
SCHEMBL10041260 0.89 ESR1 (0.67) ESR1ESR2MAPK1HTTMAPT
SCHEMBL29466073 0.89 ESR1 (0.56) ESR1ESR2MAPK1HTTMAPT
SCHEMBL15154977 0.89 ESR1 (0.56) ESR1ESR2MAPK1HTTMAPT
SCHEMBL28153332 0.88 ESR1 (0.61) ESR1ESR2MAPK1HTTMAPT
SCHEMBL16116629 0.87 ESR1 (0.55) ESR1ESR2MAPK1HTTMAPT
SCHEMBL21769826 0.87 DCTPP1 (0.47) ESR1ESR2MAPTHDAC1HDAC8
SCHEMBL28200380 0.86 MAPT (0.47) ESR1ESR2MAPK1HTTMAPT
SCHEMBL541157 0.84 ESR2 (0.78) ESR1ESR2MAPK1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12252485-B2 Heterocyclic compound and organic light emitting device comprising same LT MATERIALS CO., LTD. (KR) 2025-03-18 — — US disclosed
CN-113891888-B Heterocyclic compound and organic light-emitting device comprising same LT素材株式会社 2024-04-26 — — CN disclosed
CN-114560813-B Benzimidazole MK2 allosteric inhibitor and preparation method and application thereof 南京中医药大学 2023-09-12 — — CN disclosed
US-11643414-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-05-09 — — US disclosed
US-11643414-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-05-09 — — US disclosed
US-20220213098-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2022-07-07 — — US disclosed
CN-114560813-A Benzimidazole MK2 allosteric inhibitor and preparation method and application thereof 南京中医药大学 2022-05-31 — — CN disclosed
CN-110818687-B Compound and organic electroluminescent device 北京鼎材科技有限公司 2022-05-03 — — CN disclosed
CN-113891888-A Heterocyclic compound and organic light-emitting device comprising same LT素材株式会社 2022-01-04 — — CN disclosed
US-11208401-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-12-28 — — US disclosed
EP-2533316-A1 6, 12-dinaphthylchrysene derivative and organic light-emitting device using the derivative Canon Kabushiki Kaisha (JP) 2012-12-12 — — EP disclosed
EP-2525425-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Idemitsu Kosan Co., Ltd. (JP) 2012-11-21 — — EP disclosed
EP-2524913-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME Idemitsu Kosan Co., Ltd. (JP) 2012-11-21 — — EP disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
US-20120132899-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-31 — — US disclosed
US-20120132899-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-31 — — US disclosed
US-20120132899-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-31 — — US disclosed
CN-102473857-A Organic electroluminescent element IDEMITSU KOSAN CO 2012-05-23 — — CN 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 (5 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-20120132899-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME H1-2, L1CAM, H1-0 ESR1 60/4885ESR2 16/4885MAPK1 655/4885
US-11208401-B2 Materials for organic electroluminescent devices DDT, CELF2, BRD3 ESR1 1278/4885ESR2 1338/4885MAPK1 2408/4885
US-12252485-B2 Heterocyclic compound and organic light emitting device comprising same CRY1, CYP1A1, CYP1B1 ESR1 112/4885ESR2 706/4885MAPK1 506/4885
US-20220213098-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 ESR1 112/4885ESR2 706/4885MAPK1 506/4885
US-11643414-B2 Materials for organic electroluminescent devices SLCO4C1, SLCO2A1, PIEZO1 ESR1 224/4885ESR2 324/4885MAPK1 328/4885

“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.