SCHEMBL80153

SCHEMBL80153

N#Cc1cc(Br)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.43
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42
MAOB P27338 3/20 0.41
MAOA P21397 2/20 0.41
AR P10275 1/20 0.38
SLC1A5 Q15758 1/20 0.37
GRM4 Q14833 1/20 0.36
CNR2 P34972 1/20 0.36
FLT3 P36888 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
PTP4A3 O75365 1/20 0.36
DGAT1 O75907 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
CHEK1 O14757 1/20 0.35
PGR P06401 1/20 0.35
MCL1 Q07820 1/20 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
SCHEMBL29439602 1.00 TRPV4 (0.43) TRPV4CYP11B1CYP11B2MAOBMAOA
SCHEMBL56634 0.82 TRPV4 (0.57) TRPV4CYP11B1CYP11B2MAOBMAOA
SCHEMBL3639193 0.79 CYP11B1 (0.34) CYP11B1CYP11B2MAOBMAOAAR
SCHEMBL1395661 0.78 MAOB (0.61) CYP11B1CYP11B2MAOBMAOASLC1A5
SCHEMBL30475151 0.78 MAOB (0.61) CYP11B1CYP11B2MAOBMAOASLC1A5
SCHEMBL3636063 0.78 PTGES (0.33) CYP11B1CYP11B2AR
SCHEMBL26623457 0.78 CYP2A6 (0.42) TRPV4CYP11B1CYP11B2MAOBMAOA
SCHEMBL5958536 0.77 PYCR1 (0.39) ESR1ESR2DGAT1
SCHEMBL16961441 0.77 DGAT1 (0.35) DGAT1
SCHEMBL2890266 0.77 CNR2 (0.50) CYP11B1CYP11B2GRM4CNR2

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 1229 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957040-B Dibromo column [5] aromatic compound and preparation method thereof, conjugated polymer thereof and preparation method and application of polymer 武汉工程大学 2023-08-25 CN claimed
CN-110078668-B Phenyl imidazole XOR inhibitor, preparation and application 华南理工大学 2023-03-24 CN claimed
CN-114957040-A Dibromo column [5] arene compound, preparation method thereof, conjugated polymer thereof, preparation method and application of polymer 武汉工程大学 2022-08-30 CN claimed
CN-103936622-B 5-bromo-2-fluorobenzonitrile synthesis method Qidong dongyue pharmaceutical co ltd 2015-07-15 CN claimed
CN-102190797-A Quick synthesizing method of triazinyl covalent bond organic framework material with nano pores and application thereof UNIV ANHUI 2011-09-21 CN claimed
US-12637428-B2 Isoquinoline derivatives as SIK2 inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2026-05-26 US disclosed
EP-4105216-B1 DIHYDRONAPHTHYRIDINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF GENFLEET THERAPEUTICS SHANGHAI INC (CN) 2026-05-20 EP disclosed
US-12624051-B2 Macrocyclic compounds, compositions, and methods of using thereof GENZYME CORPORATION (US) 2026-05-12 US disclosed
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase JANSSEN PHARMACEUTICA NV (BE) 2026-05-05 US disclosed
US-20260062393-A1 Compounds CTXT PTY LTD (AU) 2026-03-05 US disclosed
US-12543496-B2 Organic molecules for optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2026-02-03 US disclosed
US-20260008785-A1 MACROCYCLIC COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF SCHRODINGER, LLC 2026-01-08 US disclosed
US-5696127-A Steroid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-12-09 US disclosed
US-5696130-A Tricyclic steroid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-12-09 US disclosed
US-5693647-A Steroid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-12-02 US disclosed
US-5693646-A Steroid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-12-02 US disclosed
US-5688808-A Steroid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-11-18 US disclosed
US-5688810-A Steroid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-11-18 US disclosed
EP-0800519-A1 STEROID RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 1997-10-15 EP disclosed
WO-1996019458-A2 STEROID RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 1996-06-27 WO 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 (6 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-12624051-B2 Macrocyclic compounds, compositions, and methods of using thereof CFTR, ABCC3, ABCD3 TRPV4 510/4885CYP11B1 1916/4885CYP11B2 1572/4885
US-20260008785-A1 MACROCYCLIC COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF CFTR, ABCC3, ABCD3 TRPV4 516/4885CYP11B1 2062/4885CYP11B2 1692/4885
US-12637428-B2 Isoquinoline derivatives as SIK2 inhibitors SIK2, SIK1, SIK3 TRPV4 3530/4885CYP11B1 2670/4885CYP11B2 2011/4885
US-12543496-B2 Organic molecules for optoelectronic devices OR10J3, SCO2, ORC3 TRPV4 1356/4885CYP11B1 1118/4885CYP11B2 722/4885
US-20260062393-A1 Compounds SCN2B, ABCB11, SCN1B TRPV4 1449/4885CYP11B1 796/4885CYP11B2 629/4885
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase IRAK3, IKBKB, IKBKG TRPV4 2218/4885CYP11B1 1827/4885CYP11B2 2571/4885

“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.