SCHEMBL59841

SCHEMBL59841

CC(N)(C(=O)O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.58
CYP2C19 P33261 3/20 0.58
MAPT P10636 1/20 0.56
KMT2A Q03164 1/20 0.56
CYP2D6 P10635 2/20 0.55
HIF1A Q16665 2/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
KCNN4 O15554 2/20 0.46
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL222049 1.00 CYP1A2 (0.58) CYP1A2CYP2C19MAPTKMT2ACYP2D6
SCHEMBL220775 1.00 CYP1A2 (0.58) CYP1A2CYP2C19MAPTKMT2ACYP2D6
Methyl Alcohol SCHEMBL29003577 0.98 CYP1A2 (0.56) CYP1A2CYP2C19MAPTKMT2ACYP2D6
Hydrochloric Acid SCHEMBL6369027 0.98 CYP1A2 (0.56) CYP1A2CYP2C19MAPTKMT2ACYP2D6
Hydrochloric Acid SCHEMBL304449 0.98 CYP1A2 (0.56) CYP1A2CYP2C19MAPTKMT2ACYP2D6
Hydrochloric Acid SCHEMBL1455022 0.98 CYP1A2 (0.56) CYP1A2CYP2C19MAPTKMT2ACYP2D6
SCHEMBL30577995 0.90 CYP1A2 (0.50) CYP1A2CYP2C19MAPTKMT2ACYP2D6
SCHEMBL5565841 0.90 CYP1A2 (0.54) CYP1A2CYP2C19MAPTKMT2ACYP2D6
SCHEMBL7384716 0.87 CYP2C9 (0.57) CYP1A2CYP2C19MAPTKMT2ACYP2D6
SCHEMBL18209210 0.87 CYP1A2 (0.47) CYP1A2CYP2C19MAPTKMT2ACYP2D6

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

Appears in 4168 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119943417-A Construction method of ankylosing spondylitis ossification progress prediction model based on metabonomics and artificial intelligence 中国人民解放军海军军医大学第二附属医院 2025-05-06 CN claimed
CN-116254182-B Organ microfluidic chip and drug safety evaluation system 武汉大学 2025-02-14 CN claimed
CN-119075601-A Organic amine composition, carbon dioxide absorbent and application thereof 国家能源集团新能源技术研究院有限公司 2024-12-06 CN claimed
CN-118996022-A Organic leather tanning agent with covalent tanning characteristics, and preparation method and application thereof 四川德赛尔新材料科技有限公司 2024-11-22 CN claimed
US-20240326017-A1 FIBER-ENCAPSULATED HYBRID MATERIALS FOR CAPTURE OF CARBON DIOXIDE UT BATTELLE LLC (US) 2024-10-03 US claimed
US-20240316143-A1 THERAPEUTIC AGENTS AND/OR PHARMACEUTICAL COMPOSITIONS FOR NEUROCOGNITIVE DISORDERS IMAMURA Jyunichi (JP) 2024-09-26 US claimed
CN-114246953-B Anti-cMet antibody drug conjugates and methods of use thereof 艾伯维生物制药股份有限公司 2024-07-09 CN claimed
WO-2024142211-A1 THERAPEUTIC AGENT FOR DEMENTIA 今村 純一 2024-07-04 WO claimed
CN-117517541-B Method for measuring concentration of glycylglycine in blood plasma 重庆医科大学 2024-06-14 CN claimed
CN-117929712-A Pine wood epidemic rapid detection test strip for pine wood nematode infection and preparation method thereof 基因赛奥(大连)生物科技发展有限公司 2024-04-26 CN claimed
EP-0273645-A2 Novel derivatives of arginine vasopressin antagonists THE MEDICAL COLLEGE OF OHIO (US) 1988-07-06 EP claimed
US-4714696-A Novel derivatives of arginine vasopressin antagonists MEDICAL COLLEGE OF OHIO (US) 1987-12-22 US claimed
US-4649130-A Novel derivatives of arginine vasopressin antagonists MEDICAL COLLEGE OF OHIO (US) 1987-03-10 US claimed
EP-0189326-A2 Derivatives of arginine vasopressin antagonists Medical College of Ohio (US) 1986-07-30 EP claimed
US-4551445-A Derivatives of arginine vasopressin antagonists THE MEDICAL COLLEGE OF OHIO (US) 1985-11-05 US claimed
EP-0151016-A2 Arginine vasopressin antagonists Medical College of Ohio (US) 1985-08-07 EP claimed
EP-0061356-B1 ANTAGONISTS OF THE ANTIDIURETIC AND/OR VASOPRESSOR ACTION OF ARGININE VASOPRESSIN Medical College of Ohio (US) 1985-07-17 EP claimed
EP-0138604-A2 Arginine vasopressin antagonists Medical College of Ohio (US) 1985-04-24 EP claimed
US-4399125-A CYCLIC OLIGOPEPTIDES TRUSTEES OF COLUMBIA UNIVERSITY THE, A CORP. OF NY. 1983-08-16 US claimed
EP-0061356-A2 Antagonists of the antidiuretic and/or vasopressor action of arginine vasopressin Medical College of Ohio (US) 1982-09-29 EP claimed