SCHEMBL123540

SCHEMBL123540

CCCc1ccccn1.c1cc2ccc1-2

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.55
HRH3 Q9Y5N1 2/20 0.55
ALDH1A1 P00352 2/20 0.53
LMNA P02545 2/20 0.53
TAAR1 Q96RJ0 1/20 0.53
ALOX15 P16050 1/20 0.53
CYP1A2 P05177 4/20 0.47
CYP2C19 P33261 2/20 0.47
USP2 O75604 1/20 0.47
TDP1 Q9NUW8 3/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
TSHR P16473 1/20 0.46
CYP2D6 P10635 2/20 0.46
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LIN28A Q9H9Z2 1/20 0.44
CYP19A1 P11511 1/20 0.43
CYP2C9 P11712 1/20 0.43
HRH4 Q9H3N8 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
SCHEMBL10527 0.94
SCHEMBL29583126 0.94
SCHEMBL11564094 0.91 HRH1 (0.59) HRH1HRH3ALDH1A1LMNATAAR1
SCHEMBL30101413 0.91 HRH1 (0.59) HRH1HRH3ALDH1A1LMNATAAR1
Iodide SCHEMBL22551708 0.91 HRH1 (0.59) HRH1HRH3ALDH1A1LMNATAAR1
Ammonia Solution, Strong SCHEMBL1509120 0.91 HRH1 (0.59) HRH1HRH3ALDH1A1LMNATAAR1
Hydrochloric Acid SCHEMBL28050227 0.91 ALDH1A1 (0.62) HRH1HRH3ALDH1A1LMNATAAR1
Bromide SCHEMBL14801933 0.91 HRH1 (0.59) HRH1HRH3ALDH1A1LMNATAAR1
Methylamine SCHEMBL4067487 0.89 HRH1 (0.63) HRH1HRH3ALDH1A1LMNATAAR1
Bromide SCHEMBL28271951 0.89 HRH1 (0.57) HRH1HRH3ALDH1A1LMNATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113214445-B Binder based on benzyl ether type phenolic resin containing free phenol and free hydroxy benzyl alcohol ASK化学品股份有限公司 2024-10-11 CN claimed
EP-4251344-B1 METHOD OF PRODUCING MOLDS, CORE OR RISER HUETTENES ALBERTUS CHEMISCHE WERKE GMBH (DE) 2024-10-02 EP claimed
US-12037444-B2 Phenolic resin binder with reduced formaldehyde content ASK CHEMICALS GMBH (DE) 2024-07-16 US claimed
US-20240001433-A1 PRODUCTION METHOD, CASTING MOULDS, CORES OR FEEDERS AND KIT AND METHOD FOR PRODUCTION OF A METALLIC CASTING HÜTTENES-ALBERTUS Chemische Werke Gesellschaft mit beschränkter Haftung (DE) 2024-01-04 US claimed
US-11839913-B2 Binder systems IMERYS USA, INC. (US) 2023-12-12 US claimed
EP-4251344-A1 PRODUCTION METHOD, CASTING MOULDS, CORES OR FEEDERS AND KIT AND METHOD FOR PRODUCTION OF A METALLIC CASTING HÜTTENES-ALBERTUS Chemische Werke Gesellschaft mit beschränkter Haftung (DE) 2023-10-04 EP claimed
CN-116568425-A Method for producing a casting mould, core or riser, kit and method for producing a metal casting 胡坦斯·阿尔伯图斯化学厂有限公司 2023-08-08 CN claimed
US-11466117-B2 Binder based on phenolic resins of the benzyl ether type, containing free phenol and free hydroxybenzyl alcohols ASK CHEMICALS GMBH (DE) 2022-10-11 US claimed
CN-111566139-B Phenolic resin binder with reduced formaldehyde content ASK化学品股份有限公司 2022-07-08 CN claimed
WO-2022112515-A1 PRODUCTION METHOD, CASTING MOULDS, CORES OR FEEDERS AND KIT AND METHOD FOR PRODUCTION OF A METALLIC CASTING HÜTTENES-ALBERTUS Chemische Werke Gesellschaft mit beschränkter Haftung (DE) 2022-06-02 WO claimed
US-5948930-A Process for preparing O-alkyl, O-alkylphosphorochloridothioates BAYER CORPORATION (US) 1999-09-07 US claimed
US-5698613-A Chemical binder MANCUSO CHEMICALS LIMITED (CA) 1997-12-16 US claimed
EP-0811027-A1 CHEMICAL BINDER Mancuso Chemicals Limited (CA) 1997-12-10 EP claimed
WO-1996026231-A1 CHEMICAL BINDER MANCUSO CHEMICALS LIMITED (CA) 1996-08-29 WO claimed
US-5001190-A Process for filling space in a structure with a polyurethane composite in the presence of water ASHLAND OIL, INC. (US) 1991-03-19 US claimed
US-4855383-A In situ quaternary ammonium catalyst formation for curing polymeric isocyanates ASHLAND OIL, INC. (US) 1989-08-08 US claimed
US-4788083-A POLYURETHANES, POT LIFE ASHLAND OIL, INC. (US) 1988-11-29 US claimed
WO-1988003090-A1 POLYURETHANE COMPOSITES COMPRISING A COARSE AGGREGATE AND CERTAIN POLYURETHANE BINDERS ASHLAND OIL, INC. (US) 1988-05-05 WO claimed
US-4517222-A Vaporous amine catalyst spray method of applying a film to a substrate ASHLAND OIL, INC. (US) 1985-05-14 US claimed
US-4179427-A FONDRIES, TERTIARY AMINE OR METAL ION CURING AGENT ASHLAND OIL, INC. (US) 1979-12-18 US claimed