SCHEMBL45709

SCHEMBL45709

Brc1cc(Br)c(I)c(Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
AHR P35869 2/20 0.38
ALOX15 P16050 2/20 0.35
HSP90AA1 P07900 1/20 0.33
TLR9 Q9NR96 1/20 0.33
AKR1C4 P17516 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
ERN1 O75460 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 2/20 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
SCHEMBL12699692 0.80 CYP3A4 (0.38) TDP1CYP3A4TSHRGABRA1GABRB1
SCHEMBL7643820 0.80 CYP3A4 (0.38) TDP1CYP3A4TSHRGABRA1GABRB1
SCHEMBL16180654 0.79 APEX1 (0.37) CA1CA2APEX1
SCHEMBL23648084 0.73 ALDH1A1 (0.35) TSHRALDH1A1MAPK1CA1CA9
SCHEMBL28981145 0.73 GAA (0.58) CYP3A4TSHRALOX15ALDH1A1MAPK1
SCHEMBL23648094 0.73 TSHR (0.41) CYP3A4TSHRAHRERN1ALDH1A1
SCHEMBL1393362 0.73 GAA (0.35) KMT2ACA1CA9MAPT
SCHEMBL24665431 0.71 AKR1C3 (0.44) TDP1CYP3A4TSHRGABRA1GABRB1
SCHEMBL7648574 0.71 ERN1 (0.44) CYP3A4ERN1ALDH1A1L3MBTL1HTT
SCHEMBL6660944 0.69 APEX1 (0.60) TDP1CYP3A4TSHRGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109824474-A The preparation method of one kind 3,5- diphenyl bromobenzene 辽宁博美医药科技有限公司 2019-05-31 CN claimed
CN-119409551-B Continuous synthesis method and device for m-terphenyl compound 广东工业大学 2025-04-18 CN disclosed
CN-119409551-A Continuous synthesis method and device for m-terphenyl compound 广东工业大学 2025-02-11 CN disclosed
US-10644243-B2 N-phenyl triscarbazole NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2020-05-05 US disclosed
CN-109824474-A The preparation method of one kind 3,5- diphenyl bromobenzene 辽宁博美医药科技有限公司 2019-05-31 CN disclosed
EP-2787053-B1 Polymeric materials MERCK PATENT GMBH (DE) 2018-11-21 EP disclosed
US-10079344-B2 Asymmetric monoanthracene derivative, material for organic electroluminescent device and organic electroluminescent device utilizing the same IDEMITSU KOSAN CO., LTD. (JP) 2018-09-18 US disclosed
EP-2627732-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2017-12-20 EP disclosed
EP-2627732-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2017-12-20 EP disclosed
CN-105399074-B A kind of graphene nanobelt and its synthetic method and application 华南理工大学 2017-06-06 CN disclosed
EP-1707550-A1 ASYMMETRIC MONOANTHRACENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE UTILIZING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2006-10-04 EP disclosed
CN-1165564-C Polyarylene compositions with enhanced modulus profiles 2004-09-08 CN disclosed
US-6646081-B2 Useful in making low dielectric constant insulating layers in microelectronic devices DOW GLOBAL TECHNOLOGIES INC. 2003-11-11 US disclosed
CN-1391590-A Polyarylene compositions with enhanced modulus profiles DOW WORLDWIDE TECHNOLOGIES INC (US) 2003-01-15 CN disclosed
EP-1244724-A1 POLYARYLENE COMPOSITIONS WITH ENHANCED MODULUS PROFILES Dow Global Technologies, Inc. (US) 2002-10-02 EP disclosed
US-20020099158-A1 Useful in making low dielectric constant insulating layers in microelectronic devices THE DOW CHEMICAL COMPANY 2002-07-25 US disclosed
US-6359091-B1 AS DIELECTRICS IN SEMICONDUCTORS THE DOW CHEMICAL COMPANY 2002-03-19 US disclosed
WO-2001038417-A1 POLYARYLENE COMPOSITIONS WITH ENHANCED MODULUS PROFILES DOW GLOBAL TECHNOLOGIES INC. (US) 2001-05-31 WO disclosed
US-4629815-A ALKALI METAL AMIDE OR ALKALI METAL ALCOHOLATE AND COMPLEXING AGENT RHONE-POULENC INDUSTRIES (FR) 1986-12-16 US disclosed
US-4006023-A Photographic polymeric composition containing a leuco dye cyanide THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH, EDUCATION AND WELFARE (US) 1977-02-01 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-10079344-B2 Asymmetric monoanthracene derivative, material for organic electroluminescent device and organic electroluminescent device utilizing the same EML4, EED, LAGE3 TDP1 1982/4885CYP3A4 1314/4885TSHR 4818/4885
US-10644243-B2 N-phenyl triscarbazole RB1, LBR, NR1I2 TDP1 2934/4885CYP3A4 147/4885TSHR 377/4885

“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.