SCHEMBL1256167

SCHEMBL1256167

O=C(c1ccc(Cl)cc1)N1CCNCC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.68
HPGD P15428 3/20 0.64
ALDH1A1 P00352 3/20 0.64
POLB P06746 1/20 0.64
PHGDH O43175 1/20 0.64
HSD17B10 Q99714 1/20 0.64
MAPT P10636 1/20 0.58
MGLL Q99685 1/20 0.58
SCN5A Q14524 1/20 0.57
SCN2A Q99250 1/20 0.57
SCN10A Q9Y5Y9 1/20 0.57
KMT2A Q03164 2/20 0.57
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA7 P43166 1/20 0.57
CA9 Q16790 1/20 0.57
CA14 Q9ULX7 1/20 0.57
AKR1C3 P42330 1/20 0.57
CCNC P24863 1/20 0.56

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
Hydrochloric Acid SCHEMBL10901857 0.98 SIGMAR1 (0.66) SIGMAR1HPGDALDH1A1POLBPHGDH
SCHEMBL3063116 0.93 SIGMAR1 (0.60) SIGMAR1HPGDALDH1A1POLBPHGDH
SCHEMBL8358137 0.90 SIGMAR1 (0.81) SIGMAR1HPGDALDH1A1RXFP1
SCHEMBL10722382 0.86 POLB (0.81) HPGDALDH1A1POLBPHGDHHSD17B10
SCHEMBL9585721 0.86 POLB (0.81) HPGDALDH1A1POLBPHGDHHSD17B10
SCHEMBL8260488 0.85 SIGMAR1 (0.72) SIGMAR1HPGDALDH1A1POLBKMT2A
SCHEMBL3583338 0.85 HPGD (0.73) SIGMAR1HPGDALDH1A1KMT2ACA12
SCHEMBL27980800 0.84 POLB (0.51) SIGMAR1HPGDALDH1A1POLBPHGDH
SCHEMBL11104248 0.83 ALDH1A1 (0.77) HPGDALDH1A1MAPTKMT2ALMNA
SCHEMBL23140495 0.83 SIGMAR1 (0.76) SIGMAR1HPGDALDH1A1CCNCCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113848271-B Method for detecting related substances in levocetirizine hydrochloride oral solution 浙江核力欣健药业有限公司 2023-04-28 CN claimed
US-20140273458-A1 Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-18 US claimed
EP-2779217-A2 Chemical mechanical planarization for tungsten-containing substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-17 EP claimed
CN-104046246-A Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PROD & CHEM 2014-09-17 CN claimed
CN-103006659-B Application of substituted piperazine compound in preparation of medicament for resisting fungal infection UNIV DALI 2014-09-17 CN claimed
CN-103006659-A Application of substituted piperazine compound in preparation of medicament for resisting fungal infection UNIV DALI 2013-04-03 CN claimed
CN-117820287-B Magnolol derivative, and preparation method and application thereof CHINA PHARMACEUTICAL UNIVERSITY (CN) 2026-05-26 CN disclosed
CN-116203156-B Detection method of cetirizine oral liquid preparation related impurities 北京柏雅联合药物研究所有限公司 2024-09-03 CN disclosed
CN-118191142-A Method for determining and separating levocetirizine hydrochloride and related substances thereof 南京海京康医药科技有限公司 2024-06-14 CN disclosed
CN-118191142-A Method for determining and separating levocetirizine hydrochloride and related substances thereof 南京海京康医药科技有限公司 2024-06-14 CN disclosed
CN-117820287-A Magnolol derivative, and preparation method and application thereof 中国药科大学 2024-04-05 CN disclosed
CN-116203156-A Detection method of cetirizine oral liquid preparation related impurities 北京柏雅联合药物研究所有限公司 2023-06-02 CN disclosed
CN-110520127-B Piperidinyl-substituted and piperazinyl-substituted heteroaromatic carboxamides as modulators of GPR6 武田药品工业株式会社 2023-05-16 CN disclosed
US-4983606-A Pharmaceutically-active phthalazine compounds ZAMBON GROUP S.P.A. (IT) 1991-01-08 US disclosed
EP-0242957-B1 1-SUBSTITUTED ALKYL-1, 2-DIHYDRO-2-PYRAZINONE DERIVATIVES TOYO JOZO KABUSHIKI KAISHA (JP) 1990-09-12 EP disclosed
US-4877875-A ANTIAGGLOMERANTS, VASODILATORS TOYO JOZO KABUSHIKI KAISHA (JP) 1989-10-31 US disclosed
US-4837319-A VASODILATORS, ANTICOAGULANTS TOYO JOZO KABUSHIKI KAISHA (JP) 1989-06-06 US disclosed
EP-0242957-A1 1-Substituted Alkyl-1, 2-Dihydro-2-Pyrazinone derivatives TOYO JOZO KABUSHIKI KAISHA (JP) 1987-10-28 EP disclosed
US-4616086-A ANTICOAGULANTS BOEHRINGER MANNHEIM GMBH (DE) 1986-10-07 US disclosed
EP-0076996-A1 Carboxylic-acid derivatives, process for their preparation and medicines containing them Roche Diagnostics GmbH (DE) 1983-04-20 EP disclosed