SCHEMBL48403

SCHEMBL48403

CC(=O)Cc1ccncc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 12/20 0.50
TSHR P16473 1/20 0.48
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTT P42858 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.42

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
Iodide SCHEMBL14765165 0.98 CYP19A1 (0.49) CYP19A1TSHRALDH1A1GAAMAPT
SCHEMBL8081061 0.90 ALDH1A1 (0.47) CYP19A1TSHRALDH1A1GAAMAPT
SCHEMBL28163187 0.90 GAA (0.54) CYP19A1TSHRALDH1A1GAAMAPT
Benzophenone SCHEMBL28109342 0.85 KMT2A (0.63) CYP19A1ALDH1A1GAAMAPT
SCHEMBL16866569 0.82 POLB (0.54) CYP19A1ALDH1A1MAPTPOLBRAB9A
SCHEMBL9630186 0.82 MAOB (0.53) ALDH1A1MAPTPOLBRAB9ASMN1; SMN2
SCHEMBL9632286 0.82 MAOB (0.53) ALDH1A1MAPTPOLBRAB9ASMN1; SMN2
SCHEMBL8403545 0.82 POLB (0.61) TSHRALDH1A1GAAPOLBHTT
SCHEMBL4681053 0.80 LOXL2 (0.46) CYP19A1TSHRALDH1A1GAAMAPT
SCHEMBL10750108 0.80 CYP19A1 (0.52) CYP19A1ALDH1A1GAAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111377857-B Method for synthesizing milrinone 鲁南制药集团股份有限公司 2023-04-18 CN claimed
CN-111377858-B Preparation method of milrinone 鲁南制药集团股份有限公司 2023-04-07 CN claimed
CN-113493411-A Method for synthesizing milrinone 鲁南制药集团股份有限公司 2021-10-12 CN claimed
CN-109562628-B Silver ion carboxylate N-heteroaromatic complex and use 柯达公司 2021-07-27 CN claimed
EP-3496951-B1 SILVER ION CARBOXYLATE N-HETEROAROMATIC COMPLEXES AND USES EASTMAN KODAK CO (US) 2021-06-23 EP claimed
CN-111484450-A Preparation method of medical intermediate milrinone 上海隆盛化工有限公司 2020-08-04 CN claimed
US-20190264331-A1 COMPOSITIONS AND METHODS FOR FORMING ARTICLES HAVING SILVER METAL BANK OF AMERICA, N.A., AS AGENT 2019-08-29 US claimed
US-10358725-B2 Compositions and methods for forming articles having silver metal EASTMAN KODAK COMPANY (US) 2019-07-23 US claimed
US-10356899-B2 Articles having reducible silver ion complexes or silver metal EASTMAN KODAK COMPANY (US) 2019-07-16 US claimed
EP-3496951-A1 SILVER ION CARBOXYLATE N-HETEROAROMATIC COMPLEXES AND USES Eastman Kodak Company (US) 2019-06-19 EP claimed
CN-1253439-C Process for preparing milrinone LUNAN PHARM GROUP CORP (CN) 2006-04-26 CN claimed
CN-1629141-A Process for preparing milrinone LUNAN PHARM GROUP CORP (CN) 2005-06-22 CN claimed
EP-0159769-B1 ELECTROCHEMICAL OXIDATION OF PYRIDINE BASES REILLY INDUSTRIES, INC. (US) 1991-03-27 EP claimed
EP-0159769-A1 Electrochemical oxidation of pyridine bases REILLY INDUSTRIES, INC. (US) 1985-10-30 EP claimed
EP-0075116-B1 PROCESS FOR PREPARING 1,2-DIHYDRO-6-METHYL-2-OXO-5-(PYRIDINYL)NICOTINONITRILES STERLING DRUG INC. (US) 1985-05-22 EP claimed
US-4482439-A Electrochemical oxidation of pyridine bases REILLY TAR & CHEMICAL CORP. (US) 1984-11-13 US claimed
US-4469871-A Process for preparing 2-(lower-alkoxy)-1-(pyridinyl) ethenyl lower-alkyl ketones STERLING DRUG INC. (US) 1984-09-04 US claimed
US-4413127-A Preparation of 1,2-dihydro-6-(lower alkyl)-2-oxo-5-(pyridinyl)nicotinonitriles STERLING DRUG INC. (US) 1983-11-01 US claimed
EP-0075116-A1 Process for preparing 1,2-dihydro-6-methyl-2-oxo-5-(pyridinyl)nicotinonitriles STERLING DRUG INC. (US) 1983-03-30 EP claimed
US-4347363-A Process for preparing 1,2-dihydro-6-methyl-2-oxo-5-(pyridinyl)nicotinonitriles STERLING DRUG INC. (US) 1982-08-31 US claimed