SCHEMBL177863

SCHEMBL177863

c1ccc(Cc2cccnc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.65
CYP11B2 P19099 1/20 0.65
TBXAS1 P24557 10/20 0.62
CALM1 P0DP23 1/20 0.57
LTA4H P09960 1/20 0.57
CYP1A2 P05177 2/20 0.56
CYP2D6 P10635 1/20 0.56
NAPRT Q6XQN6 1/20 0.55
HRH4 Q9H3N8 1/20 0.55
HRH3 Q9Y5N1 1/20 0.55
CHRNA7 P36544 1/20 0.54
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HIF1A Q16665 1/20 0.53

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
SCHEMBL29995759 1.00 CYP11B1 (0.65) CYP11B1CYP11B2TBXAS1CALM1LTA4H
Ammonia Solution, Strong SCHEMBL5999508 0.98 CYP11B1 (0.62) CYP11B1CYP11B2TBXAS1CALM1LTA4H
Hydrochloric Acid SCHEMBL10665044 0.98 TBXAS1 (0.64) CYP11B1CYP11B2TBXAS1CALM1LTA4H
SCHEMBL727185 0.93 CYP1A2 (0.62) CYP11B1CYP11B2TBXAS1CYP1A2CYP2D6
SCHEMBL28544959 0.92 CYP11B1 (0.57) CYP11B1CYP11B2TBXAS1LTA4HNAPRT
Formic Acid SCHEMBL27652252 0.88 TBXAS1 (0.61) CYP11B1CYP11B2TBXAS1CYP1A2CYP2D6
Formic Acid SCHEMBL27873645 0.87 TBXAS1 (0.55) CYP11B1CYP11B2TBXAS1CYP1A2CYP2D6
Formic Acid SCHEMBL27873643 0.87 TBXAS1 (0.59) CYP11B1CYP11B2TBXAS1CYP1A2CYP2D6
SCHEMBL14257669 0.86 CYP1A2 (0.56) CYP11B1CYP11B2TBXAS1CYP1A2CYP2D6
SCHEMBL24769738 0.84 CYP1A2 (0.54) CYP11B1CYP11B2TBXAS1CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4314945-B1 ELECTROCHROMIC ELEMENT, ELECTROCHROMIC DISPLAY DEVICE, ELECTROCHROMIC LIGHT-CONTROLLING DEVICE, AND ELECTROLYTE COMPOSITION RICOH CO LTD (JP) 2025-12-17 EP claimed
CN-119979129-A Cooling liquid, preparation method thereof, battery and power utilization device 宁德时代新能源科技股份有限公司 2025-05-13 CN claimed
CN-118345390-A Method for preparing carbonyl compound by electrocatalytic oxidation of benzyl C-H bond by pyridine nitrogen oxide 浙江大学 2024-07-16 CN claimed
CN-115710244-B Preparation method of coumarin 万华化学集团股份有限公司 2024-04-09 CN claimed
CN-113707933-B Preparation method of solid electrolyte nano dispersion liquid of lithium ion battery and solid electrolyte nano dispersion liquid 浙江蓝珧新材料科技有限公司 2024-04-09 CN claimed
CN-116497375-A Method for electrochemically preparing benzyl alcohol 中国科学院化学研究所 2023-07-28 CN claimed
CN-113046056-B Quantum dot material, preparation method thereof, quantum dot light emitting diode and light emitting device TCL科技集团股份有限公司 2023-06-16 CN claimed
CN-115710244-A Preparation method of coumarin 万华化学集团股份有限公司 2023-02-24 CN claimed
CN-112397658-B Composite material, preparation method thereof and quantum dot light-emitting diode TCL科技集团股份有限公司 2022-08-02 CN claimed
CN-113707933-A Preparation method of solid electrolyte nano dispersion liquid of lithium ion battery and solid electrolyte nano dispersion liquid 北京卫蓝新能源科技有限公司 2021-11-26 CN claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
US-5858317-A Method for preparing cyanophosphonate derivatives from phosphoric anhydride and cyanide MONSANTO COMPANY (US) 1999-01-12 US claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998029106-A9 METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE 1998-12-23 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
WO-1998029419-A1 CYANOPHOSPHORUS COMPOUNDS AND THEIR PREPARATION MONSANTO COMPANY (US) 1998-07-09 WO claimed
WO-1998029106-A2 METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE MONSANTO COMPANY (US) 1998-07-09 WO claimed
US-5721015-A CATALYST CURING MAZDA MOTOR CORPORATION (JP) 1998-02-24 US claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed
US-4124386-A Color diffusion transfer receiving layer comprising polymeric quaternary n-heterocyclic mordant FUJI PHOTO FILM CO., LTD. (JP) 1978-11-07 US claimed