SCHEMBL484716

SCHEMBL484716

Brc1ccc2cnccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.56
CYP11B2 P19099 1/20 0.56
CYP2A6 P11509 1/20 0.50
CDK9 P50750 2/20 0.47
GSK3A P49840 1/20 0.47
CDK5 Q00535 1/20 0.47
TAOK1 Q7L7X3 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP19A1 P11511 2/20 0.46
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP3A4 P08684 1/20 0.45
CCNT1 O60563 1/20 0.44
PIM1 P11309 1/20 0.44
HASPIN Q8TF76 1/20 0.44

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
SCHEMBL29547785 1.00 CYP11B1 (0.56) CYP11B1CYP11B2CYP2A6CDK9GSK3A
Ammonia Solution, Strong SCHEMBL27725592 0.98 CYP11B1 (0.55) CYP11B1CYP11B2CYP2A6CDK9GSK3A
Water SCHEMBL28177305 0.98 CYP11B1 (0.55) CYP11B1CYP11B2CYP2A6CDK9GSK3A
SCHEMBL692484 0.91 CYP11B1 (0.52) CYP11B1CYP11B2CYP2A6CDK9GSK3A
SCHEMBL30368907 0.91 CYP11B1 (0.52) CYP11B1CYP11B2CYP2A6CDK9GSK3A
SCHEMBL31595960 0.89 CYP11B1 (0.50) CYP11B1CYP11B2CYP2A6CDK9GSK3A
Hydrochloric Acid SCHEMBL2241644 0.89 CYP11B1 (0.50) CYP11B1CYP11B2CYP2A6CDK9GSK3A
Formic Acid SCHEMBL28223024 0.89 CYP11B1 (0.47) CYP11B1CYP11B2CYP2A6CDK9GSK3A
Biphenyl SCHEMBL27880420 0.89 CYP11B1 (0.60) CYP11B1CYP11B2CYP2A6CDK9GSK3A
SCHEMBL28933997 0.84 CYP11B1 (0.59) CYP11B1CYP11B2CDK9CDK5CLK4

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 1038 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954771-A Water-soluble AIE functional molecule and application thereof in latent fingerprint imaging 辽宁石油化工大学 2025-05-09 CN claimed
CN-119331601-A Preparation and application methods of room-temperature phosphorescent material based on octatomic cucurbituril and 6-bromoisoquinoline derivatives 贵州大学 2025-01-21 CN claimed
CN-118546089-A Tetrahydroisoquinoline derivative and application thereof as acrB efflux pump inhibitor with membrane permeabilization function in antibiosis 山东大学 2024-08-27 CN claimed
CN-114805204-B Method for preparing 4-iodoisoquinoline-1 (2H) -ketone compound 云南师范大学 2023-09-15 CN claimed
CN-111606895-B Synthesis method of 1-alkyl-isoquinoline compound 武汉英纳氏药业有限公司 2021-12-21 CN claimed
CN-108084090-B Synthetic method of brominated compound containing nitrogen heterocycle as drug intermediate 北京六合宁远科技有限公司 2020-03-17 CN claimed
CN-106831575-B A kind of preparation method of 1- aminoisoquinoline -6- methanol 北京六合宁远科技有限公司 2019-04-16 CN claimed
CN-106831576-B Preparation method of 2-methyl-1-oxo-1, 2-dihydroisoquinoline-6-formic acid 北京六合宁远科技有限公司 2019-04-16 CN claimed
US-10125226-B2 Scale-up process of bifunctionalized triblock copolymers with secondary and tertiary amines, with application in dewatering and desalting of heavy crude oils INSTITUTO MEXICANO DEL PETROLEO (MX) 2018-11-13 US claimed
CN-108084090-A Synthetic method of brominated compound containing nitrogen heterocycle as drug intermediate 北京六合宁远科技有限公司 2018-05-29 CN claimed
CN-106831576-A Preparation method of 2-methyl-1-oxo-1, 2-dihydroisoquinoline-6-formic acid 北京六合宁远科技有限公司 2017-06-13 CN claimed
CN-106831575-A A kind of preparation method of the methyl alcohol of 1 aminoisoquinoline 6 北京六合宁远科技有限公司 2017-06-13 CN claimed
CN-104370813-A Preparation method of isoquinoline-6-formaldehyde UNIV SHANGHAI 2015-02-25 CN claimed
US-20140364566-A1 SCALE-UP PROCESS OF BIFUNCTIONALIZED TRIBLOCK COPOLYMERS WITH SECONDARY AND TERTIARY AMINES, WITH APPLICATION IN DEWATERING AND DESALTING OF HEAVY CRUDE OILS INSTITUTO MEXICANO DEL PETROLEO (MX) 2014-12-11 US claimed
US-20260137677-A1 PROTACS USEFUL AGAINST THE MAIN PROTEASE SARS-COV-2 TOCRIS COOKSON LTD (GB) 2026-05-21 US disclosed
EP-4741397-A1 FUSED TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shenzhen Zhongge Biological Technology Co., Ltd. (CN) 2026-05-13 EP disclosed
US-20260116896-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2026-04-30 US disclosed
EP-0975600-A1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS ANTITHROMBOTIC AGENTS Akzo Nobel N.V. (NL) 2000-02-02 EP disclosed
WO-1999020608-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER LIMITED (GB) 1999-04-29 WO disclosed
WO-1998047876-A1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS ANTITHROMBOTIC AGENTS AKZO NOBEL N.V. (NL) 1998-10-29 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 (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-20260116896-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LBR, GLRB, NR1D2 CYP11B1 1906/4885CYP11B2 2174/4885CYP2A6 2449/4885
US-20260137677-A1 PROTACS USEFUL AGAINST THE MAIN PROTEASE SARS-COV-2 XIAP, MDM2, SARS1 CYP11B1 4443/4885CYP11B2 4376/4885CYP2A6 4385/4885

“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.