SCHEMBL1427697

SCHEMBL1427697

NCCc1ccccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 7/20 1.00
HSPA5 P11021 1/20 0.56
IDO1 P14902 2/20 0.52
MPO P05164 3/20 0.52
CYP2D6 P10635 1/20 0.50
TSHR P16473 1/20 0.50
HIF1A Q16665 1/20 0.50
HTR2A P28223 1/20 0.50
MEN1 O00255 1/20 0.50
GAPDH P04406 1/20 0.50
THRB P10828 1/20 0.50
APEX1 P27695 1/20 0.50
RAD52 P43351 1/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HTR2C P28335 1/20 0.48
HTR1A P08908 1/20 0.48
SLC6A4 P31645 1/20 0.48

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
SCHEMBL29769908 1.00 TAAR1 (1.00) TAAR1HSPA5IDO1MPOCYP2D6
Hydrochloric Acid SCHEMBL8539880 0.98 TAAR1 (0.95) TAAR1HSPA5IDO1MPOCYP2D6
Bromide SCHEMBL1802261 0.98 TAAR1 (0.95) TAAR1HSPA5IDO1MPOCYP2D6
Hydrochloric Acid SCHEMBL38660472 0.98 TAAR1 (0.95) TAAR1HSPA5IDO1MPOCYP2D6
Formic Acid SCHEMBL5072951 0.89 TAAR1 (0.80) TAAR1HSPA5IDO1MPOCYP2D6
SCHEMBL632783 0.86 TAAR1 (0.75) TAAR1HSPA5IDO1MPOCYP2D6
SCHEMBL940012 0.84 TAAR1 (0.72) TAAR1HSPA5IDO1MPOCYP2D6
SCHEMBL29706272 0.84 TAAR1 (0.71) TAAR1HSPA5IDO1MPOCYP2D6
SCHEMBL1222973 0.84 TAAR1 (0.71) TAAR1HSPA5IDO1MPOCYP2D6
SCHEMBL11123444 0.82 TAAR1 (0.69) TAAR1HSPA5IDO1MPOCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119069619-A Negative electrode plate, battery comprising same and electricity utilization device 宁德时代新能源科技股份有限公司 2024-12-03 CN claimed
CN-113855851-B Hydrogel and preparation method and application thereof 广东省科学院健康医学研究所 2023-03-31 CN claimed
CN-115228290-A Preparation method of cleaning-resistant reverse osmosis membrane 万华化学集团股份有限公司 2022-10-25 CN claimed
US-20220221433-A1 MASS SPECTROMETRY ASSAY METHODS FOR DETECTION OF METABOLITES METABOLON, INC. 2022-07-14 US claimed
EP-3977112-A1 MASS SPECTROMETRY ASSAY METHODS FOR DETECTION OF METABOLITES Metabolon Inc. (US) 2022-04-06 EP claimed
CN-113855851-A Hydrogel and preparation method and application thereof 广东省科学院健康医学研究所 2021-12-31 CN claimed
US-9670305-B2 Polyurethane dispersant and the method for its preparation Wang, Zhijun (CN) 2017-06-06 US claimed
EP-2839873-B1 POLYURETHANE DISPERSANT AND PREPARATION METHOD THEREOF WANG ZHIJUN (CN) 2017-01-04 EP claimed
CN-104277043-B One-dimensional organic semiconductor nanotube and its preparation method and application INSTITUTE OF CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2017-01-04 CN claimed
CN-103998443-B There is the cyclohexylamine derivant of the activity of beta 2-adrenergic agonist and M3 muscarine antagonist 阿尔米雷尔有限公司 2016-08-24 CN claimed
CN-1331969-A Antitumor acive matter INST OF RADIOMEDICINE ACADEMY (CN) 2002-01-23 CN claimed
WO-1996019433-A1 PROCESS FOR PREPARING ACETOXYSTYRENE HOECHST CELANESE CORPORATION (US) 1996-06-27 WO claimed
WO-1996019506-A1 PROCESS FOR PREPARING POLY(4-HYDROXYSTYRENE) HOECHST CELANESE CORPORATION (US) 1996-06-27 WO claimed
WO-1996019429-A1 PROCESS FOR PREPARING 4-HYDROXYSTYRENE HOECHST CELANESE CORPORATION (US) 1996-06-27 WO claimed
US-5493062-A Process for preparing 4-hydroxystyrene HOECHST CELANESE CORPORATION (US) 1996-02-20 US claimed
US-5463108-A Acetylation of 4-hydroxystyrene in the presence of an acetylating agent HOECHST CELANESE CORPORATION (US) 1995-10-31 US claimed
US-5463141-A Process for preparing poly(4-hydroxystyrene) HOECHST CLANESE CORPORATION (US) 1995-10-31 US claimed
WO-1994024095-A1 IMMUNOSUPPRESSIVE AGENTS ABBOTT LABORATORIES (US) 1994-10-27 WO claimed
US-4016146-A Phenethylamine antigenic conjugates, their preparation, antibodies, and use BIOLOGICAL DEVELOPMENTS, INC. (US) 1977-04-05 US claimed
US-3930948-A ENZYMATIC METHOD FOR PRODUCING AROMATIC ETHYLAMINES AJINOMOTO CO., INC. (JA) 1976-01-06 US claimed