SCHEMBL26453042

SCHEMBL26453042

CCC(C)(C(=O)O)C(=O)NC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
HTT P42858 3/20 0.48
LMNA P02545 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
KDM4E B2RXH2 1/20 0.43
GLA P06280 1/20 0.41
POLB P06746 2/20 0.40
ITGB1 P05556 1/20 0.39
ITGA4 P13612 1/20 0.39
GAA P10253 1/20 0.39
CNR2 P34972 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL14925599 0.83 ALDH1A1 (0.53) ALDH1A1HTTLMNANPSR1KDM4E
SCHEMBL14695958 0.79 HSD11B1 (0.39) ALDH1A1HTTLMNANPSR1KDM4E
SCHEMBL25765152 0.79 ALDH1A1 (0.57) ALDH1A1HTTLMNANPSR1GLA
SCHEMBL27444946 0.76 ALDH1A1 (0.58) ALDH1A1HTTLMNANPSR1GLA
SCHEMBL18308551 0.74 ALDH1A1 (0.45) ALDH1A1HTTLMNANPSR1KDM4E
SCHEMBL24084264 0.72 ALDH1A1 (0.43) ALDH1A1HTTLMNANPSR1KDM4E
SCHEMBL16000784 0.72 ALDH1A1 (0.51) ALDH1A1HTTLMNANPSR1KDM4E
SCHEMBL14925593 0.69 ALDH1A1 (0.46) ALDH1A1HTTLMNANPSR1GLA
SCHEMBL7702205 0.68 ALDH1A1 (0.59) ALDH1A1HTTLMNAKDM4EGLA
SCHEMBL3456082 0.68 LMNA (0.69) ALDH1A1HTTLMNANPSR1KDM4E

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-20230139009-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2023-05-04 US disclosed