SCHEMBL48987

SCHEMBL48987

c1cc(N2CCCCC2)ccn1

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHKA P35790 1/20 0.95
ADRB2 P07550 1/20 0.61
NCF1 P14598 1/20 0.61
PLD1 Q13393 1/20 0.61
ALDH1A1 P00352 6/20 0.52
MAPT P10636 3/20 0.52
KDM4E B2RXH2 2/20 0.52
ALOX15 P16050 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
USP2 O75604 1/20 0.52
TP53 P04637 1/20 0.52
POLB P06746 1/20 0.52
GAA P10253 1/20 0.52
THRB P10828 1/20 0.52
HTT P42858 1/20 0.52
RECQL P46063 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL30575196 1.00 CHKA (0.95) CHKAADRB2NCF1PLD1ALDH1A1
SCHEMBL2205366 1.00 CHKA (0.95) CHKAADRB2NCF1PLD1ALDH1A1
SCHEMBL10648775 1.00 CHKA (0.95) CHKAADRB2NCF1PLD1ALDH1A1
Hydrochloric Acid SCHEMBL27847995 0.98 CHKA (0.91) CHKAADRB2NCF1PLD1ALDH1A1
SCHEMBL49273 0.97 CHKA (1.00) CHKAADRB2NCF1PLD1ALDH1A1
Hydrochloric Acid SCHEMBL591914 0.95 CHKA (0.95) CHKAADRB2NCF1PLD1ALDH1A1
Iodide SCHEMBL14249446 0.95 CHKA (0.95) CHKAADRB2NCF1PLD1ALDH1A1
Hydrochloric Acid SCHEMBL29467719 0.95 CHKA (0.95) CHKAADRB2NCF1PLD1ALDH1A1
SCHEMBL19468905 0.92 CHKA (0.90) CHKAADRB2NCF1PLD1ALDH1A1
Pyridine SCHEMBL10356666 0.91 CHKA (0.79) CHKAADRB2NCF1PLD1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122037153-A Catalyst for liquid crystal polyarylester synthesis and application thereof 浙江海利得科技有限公司 2026-05-15 CN claimed
CN-119822932-A Synthesis method of 2- (1- (3, 3-dimethylcyclohexyl) ethoxy) -2-methyl-1-propanol 万华化学集团股份有限公司 2025-04-15 CN claimed
CN-119661843-A Method for synthesizing fluorinated polyimide film by using hydroalcoholic cosolvent 江苏君华特种高分子材料股份有限公司 2025-03-21 CN claimed
CN-119431469-A Idebenone derivative and preparation method and application thereof 江苏省荣军医院 2025-02-14 CN claimed
CN-119080791-A Construction of 1, 3-dioxolane derivatives by catalyzing electron-deficient alkenyl ethylene oxide through Lewis base 山东第一医科大学(山东省医学科学院) 2024-12-06 CN claimed
CN-116239445-B Method for synthesizing 1, 3-propylene glycol by propiolactone ring-opening hydrogenation 万华化学集团股份有限公司 2024-10-18 CN claimed
CN-117943108-A Phosphorus doped supported hydrogenation catalyst, preparation method and application thereof in preparation of glycol through lactone hydrogenation 万华化学集团股份有限公司 2024-04-30 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-114956926-B Method for rapidly converting carboxylic acid compounds into amide and/or ester 中国科学院兰州化学物理研究所 2023-08-11 CN claimed
CN-116239445-A Method for synthesizing 1, 3-propylene glycol by propiolactone ring-opening hydrogenation 万华化学集团股份有限公司 2023-06-09 CN claimed
EP-0127829-B1 IMPROVED STEROID ESTERS PREPARATION AB LEO (SE) 1988-02-24 EP claimed
US-4727130-A HIGH MOLECULAR WEIGHT, GOOD COLOR, HEAT RESISTANCE HULS AKTIENGESELLSCHAFT (DE) 1988-02-23 US claimed
EP-0247378-A1 Process for preparing 4-acetoxy-3-hydroxyethylazetidin-2-one derivatives KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-12-02 EP claimed
EP-0196743-A2 Stable chemical compositions containing chromogenic materials and peroxides, and method for obtaining them SAVYON DIAGNOSTICS LTD. (IL) 1986-10-08 EP claimed
US-4592869-A Selective acylation process AKTIEBOLAGET LEO (SE) 1986-06-03 US claimed
EP-0170090-A1 Substituted benzoate ester prodrug derivatives of 3-hydroxymorphinans, intermediates thereto, and processes E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-02-05 EP claimed
US-4537722-A CARBODIIMIDES WITH ACID CATALYSTS ARE USED AS CONDENSING AGENTS AB LEO (SE) 1985-08-27 US claimed
EP-0138153-A2 A selective acylation process AB LEO (SE) 1985-04-24 EP claimed
EP-0127829-A2 Improved steroid esters preparation AB LEO (SE) 1984-12-12 EP claimed
US-4066641-A METHOD FOR CYCLIZATION TO GIVE CEPHEM RING HAMASHIMA YOSHIO 1978-01-03 US claimed