SCHEMBL8428841

SCHEMBL8428841

CCCCC1CCCOO1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.45
CYP1A2 P05177 4/20 0.40
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.31
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30

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
SCHEMBL12096491 0.94 EPHX1 (0.53) EPHX1CYP1A2ALDH1A1SMN1; SMN2
SCHEMBL1111026 0.92 CYP1A2 (0.47) EPHX1CYP1A2ALDH1A1NOS1NOS2
SCHEMBL5697977 0.92 EPHX1 (0.57) EPHX1CYP1A2ALDH1A1
SCHEMBL27650515 0.92 EPHX1 (0.57) EPHX1CYP1A2ALDH1A1
SCHEMBL9419418 0.92 EPHX1 (0.57) EPHX1CYP1A2ALDH1A1
SCHEMBL3271036 0.92 EPHX1 (0.57) EPHX1CYP1A2ALDH1A1
SCHEMBL28042955 0.92 EPHX1 (0.57) EPHX1CYP1A2ALDH1A1
Acetic Acid SCHEMBL28988950 0.89 EPHX1 (0.38) EPHX1CYP1A2ALDH1A1SMN1; SMN2
SCHEMBL14678020 0.87
SCHEMBL28291510 0.87

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102311731-B The reagent of enhanced chemiluminescence, method and chemical luminescence for liquid 深圳迈瑞生物医疗电子股份有限公司 2016-08-03 CN claimed
CN-101023094-A Preparation of alkyl-substituted 2-deoxy-2-fluoro-d-ribofuranosyl pyrimidines and purines and their derivatives PHARMASSET INC (US) 2007-08-22 CN claimed
CN-104788405-B Aromatic polycyclic carboxylic acid derivatives 山东轩竹医药科技有限公司 2017-04-19 CN disclosed
CN-106443018-A Myoglobin monoclonal abzyme marking compound and preparation method thereof and detection test kit 上海科华生物工程股份有限公司 2017-02-22 CN disclosed
CN-104215778-B Crosslinked magnetic particle of a kind of C peptide monoclonal antibody and preparation method thereof and the detection kit that comprises it SHANGHAI KEHUA BIOENGINEERING CO., LTD. (CN) 2016-05-04 CN disclosed
CN-102311730-B Chemiluminescence liquid as well as reagent and method enhancing chemiluminescence SHENZHEN MINDRAY BIO MED ELECT 2014-09-24 CN disclosed
CN-102311731-A Reagent and method for enhancing chemiluminescence and chemiluminescence liquid SHENZHEN MINDRAY BIO MED ELECT 2012-01-11 CN disclosed
CN-102311730-A Chemiluminescence liquid as well as reagent and method enhancing chemiluminescence SHENZHEN MINDRAY BIO MED ELECT 2012-01-11 CN disclosed
US-5891935-A Process for preparing polymeric binders and their use for antifouling paint systems WITCO GMBH (DE) 1999-04-06 US disclosed
CN-1040371-A The preparation method of benzo two  alkanamine derivatives DU PONT (US) 1990-03-14 CN disclosed