SCHEMBL25972729

SCHEMBL25972729

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

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
LMNA P02545 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
POLB P06746 1/20 0.51
HTT P42858 3/20 0.49
CA2 P00918 1/20 0.49
GLA P06280 1/20 0.49
GAA P10253 1/20 0.46
CNR2 P34972 1/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
CYP17A1 P05093 2/20 0.45
EPHX1 P07099 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
MCOLN3 Q8TDD5 1/20 0.44

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
SCHEMBL26452007 0.85 POLB (0.49) ALDH1A1LMNANPSR1POLBHTT
SCHEMBL26459717 0.80 ALDH1A1 (0.41) ALDH1A1LMNANPSR1POLBHTT
SCHEMBL7705993 0.76 ALDH1A1 (0.67) ALDH1A1LMNAHTTCA2GLA
SCHEMBL24028229 0.74 POLB (0.42) ALDH1A1LMNANPSR1POLBHTT
SCHEMBL25765152 0.73 ALDH1A1 (0.57) ALDH1A1LMNANPSR1POLBHTT
SCHEMBL1082701 0.73 ALDH1A1 (0.56) ALDH1A1CA2GLAEPHX1
SCHEMBL19718856 0.73 ALDH1A1 (0.56) ALDH1A1CA2GLAEPHX1
SCHEMBL2841738 0.73 THRB (0.63) ALDH1A1LMNANPSR1HTTGLA
SCHEMBL23220249 0.73 THRB (0.63) ALDH1A1LMNANPSR1HTTGLA
SCHEMBL10210456 0.72 KMT2A (0.65) ALDH1A1LMNAHTTGAAEPHX1

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-20230259029-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2023-08-17 US disclosed