SCHEMBL16892802

SCHEMBL16892802

Brc1cccc(N2N=C(c3ccccc3)C=C(c3ccccc3)N2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DCTPP1 Q9H773 1/20 0.38
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ POLB P06746 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HTT P42858 2/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ PLAUR Q03405 1/20 0.35
▸ MGLL Q99685 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ ALOX5 P09917 2/20 0.34

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
SCHEMBL7259734 0.85 LMNA (0.41) ABCG2MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL17063458 0.84 NPC1 (0.39) MEN1KMT2AGAASMN1; SMN2NPC1
SCHEMBL2161417 0.82 ALDH1A1 (0.41) MEN1KMT2AGAASMN1; SMN2NPC1
SCHEMBL28490007 0.82 KDM4E (0.32) DCTPP1MEN1KMT2AGAASMN1; SMN2
SCHEMBL30508420 0.82 KDM4E (0.32) DCTPP1MEN1KMT2AGAASMN1; SMN2
SCHEMBL29035491 0.80 ALDH1A1 (0.31) DCTPP1SMN1; SMN2ALDH1A1LMNA
SCHEMBL30508404 0.80 ALDH1A1 (0.31) DCTPP1SMN1; SMN2ALDH1A1LMNA
SCHEMBL15453253 0.80 LMNA (0.32) SMN1; SMN2LMNA
SCHEMBL30051370 0.79 HTR1A (0.40) TSHRTP53HTTALDH1A1MGLL
SCHEMBL30775092 0.79 MEN1 (0.39) MEN1KMT2AGAASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118772183-A Carborane derivative with space charge transfer property and application thereof in preparation of photoelectric material 南京大学 2024-10-15 — — CN disclosed
CN-111233874-B Tri-indole compound and organic electronic element containing same 宇瑞(上海)化学有限公司 2023-02-17 — — CN disclosed
CN-111233874-A Tri-indole compound and organic electronic element containing same 宇瑞(上海)化学有限公司 2020-06-05 — — CN disclosed
CN-106977527-B A kind of organic semiconductor compound and the organic electroluminescence device using the compound 江西冠能光电材料有限公司 2019-11-08 — — CN disclosed
CN-106831798-B Compound and its organic electroluminescence device containing five-membered ring structure 上海道亦化工科技有限公司 2019-03-26 — — CN disclosed
CN-108840858-A A kind of organic electroluminescent compounds based on naphthalene and application thereof and luminescent device 上海道亦化工科技有限公司 2018-11-20 — — CN disclosed
US-9954178-B2 Aromatic amine derivative and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2018-04-24 — — US disclosed
EP-2894157-B1 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO LTD (KR) 2018-04-04 — — EP disclosed
CN-104837834-B Aromatic amine derivative and organic electroluminescent element 出光兴产株式会社 2018-04-03 — — CN disclosed
US-9865820-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-01-09 — — US disclosed
CN-106831798-A Compound and its organic electroluminescence device containing five-membered ring structure 上海道亦化工科技有限公司 2017-06-13 — — CN disclosed
US-20150325794-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-11-12 — — US disclosed
US-20150200371-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-07-16 — — US disclosed
EP-2894157-A1 Condensed cyclic compound and organic light-emitting device including the same Samsung Electronics Co., Ltd (KR) 2015-07-15 — — EP 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 (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-20150200371-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, CCNA1 DCTPP1 2036/4885ABCG2 4427/4885MEN1 179/4885
US-20150325794-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT H1-2, H1-0, H1-3 DCTPP1 4814/4885ABCG2 4324/4885MEN1 1159/4885

“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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