SCHEMBL24740948

SCHEMBL24740948

C#CCN1C(=O)C(C(C)(C)C)C(C(C)(C)C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.39
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CYP19A1 P11511 1/20 0.33
MYC P01106 1/20 0.32
MAX P61244 1/20 0.32

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
SCHEMBL13669646 0.73 F2 (0.43)
SCHEMBL18746667 0.72 MAOA (0.32) MAOAMAOB
SCHEMBL18746669 0.72 TAAR1 (0.33) MAOAMAOB
SCHEMBL23467474 0.68 KDM4E (0.30)
SCHEMBL9826491 0.65 KMT2A (0.40) AMY1AMAOAMAOBCYP19A1MYC
SCHEMBL5728688 0.64
SCHEMBL10195694 0.64 ALDH1A1 (0.45) CYP19A1
SCHEMBL15375853 0.64 ALDH1A1 (0.45) CYP19A1
SCHEMBL573005 0.64 ALDH1A1 (0.45) CYP19A1
SCHEMBL12780072 0.63 ALDH1A1 (0.45) AMY1AMAOAMAOBCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220260909-A1 NEGATIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-08-18 US disclosed