SCHEMBL74335

SCHEMBL74335

c1cc(N2CCNCC2)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 1.00
NCF1 P14598 1/20 1.00
PLD1 Q13393 1/20 1.00
CHKA P35790 1/20 0.64
ADRB1 P08588 5/20 0.61
HTR3E A5X5Y0 3/20 0.61
HTR3B O95264 3/20 0.61
HTR3A P46098 3/20 0.61
HTR3D Q70Z44 3/20 0.61
HTR3C Q8WXA8 3/20 0.61
SIGMAR1 Q99720 3/20 0.61
ALDH1A1 P00352 3/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
TSHR P16473 1/20 0.54
CYP2C19 P33261 1/20 0.54
CHRNB2 P17787 3/20 0.53
CHRNA4 P43681 3/20 0.53
PIM1 P11309 1/20 0.50

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
SCHEMBL894239 1.00 ADRB2 (1.00) ADRB2NCF1PLD1CHKAADRB1
Hydrochloric Acid SCHEMBL639824 0.98 ADRB2 (0.96) ADRB2NCF1PLD1CHKAADRB1
Bromide SCHEMBL9067259 0.96 ADRB2 (0.92) ADRB2NCF1PLD1CHKAADRB1
Formaldehyde SCHEMBL28065716 0.94 ADRB2 (0.88) ADRB2NCF1PLD1CHKAADRB1
SCHEMBL1485073 0.92 ADRB2 (0.85) ADRB2NCF1PLD1CHKAADRB1
Hydrochloric Acid SCHEMBL23932586 0.90 ADRB2 (0.81) ADRB2NCF1PLD1CHKAADRB1
SCHEMBL24990328 0.88 ADRB2 (0.78) ADRB2NCF1PLD1CHKAADRB1
Acetic Acid SCHEMBL27482977 0.87 ADRB2 (0.76) ADRB2NCF1PLD1CHKAADRB1
Phenylpiperazine SCHEMBL28173277 0.84 ADRB1 (0.77) ADRB2NCF1PLD1ADRB1HTR3E
SCHEMBL12431850 0.83 ADRB2 (0.70) ADRB2NCF1PLD1CHKAADRB1

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 1694 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036599-A Dibenzylbutane lignan LCA analogue, and preparation method and application thereof 浙江中医药大学 2026-05-15 CN claimed
CN-119823147-A Isopropanolamine compound containing benzimidazolyl and preparation method and application thereof 贵州大学 2025-04-15 CN claimed
CN-119528775-A Synthesis method of methyl propionate and propylene glycol derivative containing cyclobutyl 瑞博(苏州)制药有限公司 2025-02-28 CN claimed
CN-119371442-A Novel hybridized cuprous iodide luminescent material, preparation method and fluorescent application thereof 南方科技大学 2025-01-28 CN claimed
CN-119015834-A Carbon dioxide separation membrane and preparation method thereof 国家能源投资集团有限责任公司 2024-11-26 CN claimed
CN-115869784-B Composite nanofiltration membrane based on primary layer solvent rearrangement and catalytic activation and preparation method and application thereof 中国科学院过程工程研究所 2024-09-24 CN claimed
WO-2023167049-A1 EPOXY RESIN COMPOSITION, REINFORCING FIBER-CONTAINING EPOXY RESIN COMPOSITION, PREPREG, FIBER REINFORCED PLASTIC EMPLOYING SAME, AND THERMOPLASTIC EPOXY RESIN 日鉄ケミカル&マテリアル株式会社 2023-09-07 WO claimed
CN-114806414-B Silicon polishing composition, preparation method and application thereof 万华化学集团电子材料有限公司 2023-07-11 CN claimed
CN-115869784-A Composite nanofiltration membrane based on primary layer solvent rearrangement and catalytic activation and preparation method and application thereof 中国科学院过程工程研究所 2023-03-31 CN claimed
WO-2022241809-A1 CLASS II MAJOR HISTOCOMPATIBILITY COMPLEX EXPRESSION ENHANCING COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 司达药业(南京)有限公司 2022-11-24 WO claimed
EP-0489877-B1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES UPJOHN CO (US) 1995-09-20 EP claimed
EP-0597411-A1 Process for the preparation of phthalocyanine reactive dyes BASF Aktiengesellschaft (DE) 1994-05-18 EP claimed
US-5302613-A Antiatheroscleroic and antithrombotic 2-amino-6-phenyl-4H-pyran-4-ones THE UPJOHN COMPANY (US) 1994-04-12 US claimed
US-5252735-A Antiatherosclerotic and antithrombotic 2-amino-6-phenyl-4H-pyran-4-ones THE UPJOHN COMPANY (US) 1993-10-12 US claimed
EP-0525123-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES. UPJOHN CO (US) 1993-02-03 EP claimed
EP-0489877-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES. UPJOHN CO (US) 1992-06-17 EP claimed
WO-1992000290-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES THE UPJOHN COMPANY (US) 1992-01-09 WO claimed
WO-1991019707-A2 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1991-12-26 WO claimed
EP-0459983-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES PHARMACIA & UPJOHN COMPANY (US) 1991-12-11 EP claimed
WO-1990006921-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1990-06-28 WO claimed