SCHEMBL4585655

SCHEMBL4585655

Brc1c(Br)c2ccc3cccc4cc(Br)c(c1Br)c2c34

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.44
ERBB2 P04626 1/20 0.44
FYN P06241 1/20 0.44
MAOA P21397 1/20 0.44
ACHE P22303 1/20 0.44
AHR P35869 1/20 0.44
ALDH1A1 P00352 5/20 0.41
HPGD P15428 4/20 0.41
HSD17B10 Q99714 4/20 0.41
CYP1B1 Q16678 3/20 0.41
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
CYP1A1 P04798 2/20 0.41
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
THRB P10828 1/20 0.34
KDM4E B2RXH2 2/20 0.34
AMY1A P0DUB6 1/20 0.33

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
SCHEMBL31337704 0.84 CYP1A2 (0.41) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL557720 0.82 CYP1A2 (0.53) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4585407 0.82 ALDH1A1 (0.55) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL28659812 0.75 HSD17B10 (0.50) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL11659298 0.75 CYP1A2 (0.48) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL308801 0.74 CYP1A2 (0.57) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL31266564 0.74 CYP1A2 (0.57) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL28671978 0.74 CYP1A2 (0.57) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL28244803 0.73 ALDH1A1 (0.62) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL13146030 0.72 ALDH1A1 (0.35) CYP1A2ERBB2FYNMAOAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111636208-B Mesoporous hydrogen bond organic framework fiber composite material and preparation method and application thereof 李鹏 2022-10-11 CN claimed
CN-113652003-B Pyrene ring-containing polythiophene modified graphene heat-conducting filler and heat-conducting composite material based on same 安徽大学 2022-07-05 CN claimed
CN-113652003-A Pyrene ring-containing polythiophene modified graphene heat-conducting filler and heat-conducting composite material based on same 安徽大学 2021-11-16 CN claimed
CN-111636208-A Mesoporous hydrogen bond organic framework fiber composite material and preparation method and application thereof 李鹏 2020-09-08 CN claimed
CN-110229311-A Porous organic polymer LNUs of one kind structural unit containing pyrene and its preparation method and application 辽宁大学 2019-09-13 CN claimed
CN-110002946-A A kind of pyrenyl blue gathering induced luminescence material and its preparation method and application 陕西师范大学 2019-07-12 CN claimed
CN-109762006-A A kind of star-like non-fullerene small organic molecule acceptor material and preparation method thereof containing pyrene and imidodicarbonic diamide 湘潭大学 2019-05-17 CN claimed
CN-109400891-A A kind of cadmium Base Metal organic frame and its preparation method and application 华南师范大学 2019-03-01 CN claimed
CN-107674021-A Ancient cooking vessel shape tetramine pyrene and the film modified electrode of preparation method, ancient cooking vessel shape tetramine pyrene and preparation method 中国科学院化学研究所 2018-02-09 CN claimed
CN-105367758-A Preparation method of ferrocene-based conjugated microporous polymer UNIV HUNAN SCI & TECHNOLOGY 2016-03-02 CN claimed
CN-105111216-A Thiophene polycyclic organic semiconductor material synthesis based on pyrene BEIJING INST TECHNOLOGY 2015-12-02 CN claimed
US-9024094-B2 Fluorinated aromatic materials and their use in optoelectronics THE UNIVERSITY OF SOUTH DAKOTA (US) 2015-05-05 US claimed
EP-0216204-B1 PROCESS FOR THE PREPARATION OF 1,3,6,8-TETRABROMOPYRENE HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-12 EP claimed
WO-2025038749-A1 HYDROGEN BONDED ORGANIC FRAMEWORKS FOR DRUG DELIVERY WITH ULTRASOUND THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-02-20 WO disclosed
US-12122732-B2 Functionalized polycyclic aromatic hydrocarbon compound and light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-10-22 US disclosed
US-11918951-B2 MOF compositions for selective separation of hydrocarbons RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2024-03-05 US disclosed
CN-1321104-C 1,3,6,8-tetra substituted pyrene compound, organic electroluminescent elements using the same compound, and organis electroluminescent display device FUJITSU LTD (JP) 2007-06-13 CN disclosed
CN-1487778-A 1,3,6,8-tetra substituted pyrene compound, organic electroluminescent elements using the same compound, and organis electroluminescent display device ��ʿͨ��ʽ���� 2004-04-07 CN disclosed
US-4684753-A Process for preparing 1,3,6,8-tetrabromopyrene HOECHST AKTIENGESELLSCHAFT (DE) 1987-08-04 US disclosed
US-4599431-A Process for the preparation of naphthalene-1,4,5,8-tetracarboxylic acid and its 1,8-monoanhydride in a high degree of purity HOECHST AKTIENGESELLSCHAFT (DE) 1986-07-08 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 (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-11918951-B2 MOF compositions for selective separation of hydrocarbons EPCAM, TPR, TNFSF10 CYP1A2 4254/4885ERBB2 3372/4885FYN 556/4885
US-12122732-B2 Functionalized polycyclic aromatic hydrocarbon compound and light-emitting device including the same AHR, PAH, ARNT CYP1A2 150/4885ERBB2 3779/4885FYN 4076/4885

“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.