Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL28600968

Cc1nc2c(C)cccc2o1.N

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.59
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
FBP1 P09467 1/20 0.40
F2RL3 Q96RI0 3/20 0.39
PARP1 P09874 1/20 0.38
AGPAT2 O15120 1/20 0.37

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
SCHEMBL5537231 0.98 ELANE (0.61) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL28392145 0.87 ELANE (0.56) ELANEKDM4EMEN1ALDH1A1KMT2A
Phenol SCHEMBL28860331 0.86 ELANE (0.50) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL5536407 0.78 ELANE (0.44) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL1821481 0.78 FBP1 (0.45) ELANEALDH1A1FBP1F2RL3AGPAT2
SCHEMBL24807093 0.78 ELANE (0.44) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL2761642 0.78 ELANE (0.44) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL5537227 0.78 ELANE (0.41) ELANEKDM4EALDH1A1FBP1F2RL3
SCHEMBL5544045 0.78 ELANE (0.44) ELANEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL5546211 0.78 ELANE (0.44) ELANEKDM4EMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116157398-A 2- (4- ((5- (benzo [ b ] thiophen-3-yl) -1H-tetrazol-1-yl) methyl) phenyl) -5- (difluoromethyl) -1,3, 4-oxadiazole derivatives and similar compounds as selective inhibitors of histone deacetylase 6 (HDAC 6) for the treatment of, for example, peripheral neuropathy 意大发马克股份公司 2023-05-23 CN claimed
CN-117926287-A Method for synthesizing 2-aminobenzoxazole derivative under electrochemical condition 湘潭大学 2024-04-26 CN disclosed
CN-116157398-A 2- (4- ((5- (benzo [ b ] thiophen-3-yl) -1H-tetrazol-1-yl) methyl) phenyl) -5- (difluoromethyl) -1,3, 4-oxadiazole derivatives and similar compounds as selective inhibitors of histone deacetylase 6 (HDAC 6) for the treatment of, for example, peripheral neuropathy 意大发马克股份公司 2023-05-23 CN disclosed
CN-113200969-B PI3K alpha selective inhibitor and preparation method and application thereof 中国药科大学 2022-11-25 CN disclosed
CN-113200969-A PI3K alpha selective inhibitor and preparation method and application thereof 中国药科大学 2021-08-03 CN disclosed