SCHEMBL20024451

SCHEMBL20024451

CCC(C)(C)C(=O)OCCOCC(=O)OCC1CO1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
MGLL Q99685 4/20 0.34

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
SCHEMBL20024433 0.88 HMGCR (0.30)
SCHEMBL18326353 0.87 SMN1; SMN2 (0.46) ALDH1A1TSHRMAPK1TP53CYP3A4
SCHEMBL20024441 0.87 ALDH1A1 (0.42) ALDH1A1TSHRMAPK1TP53CYP3A4
SCHEMBL20024440 0.86 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1TP53CYP3A4
SCHEMBL14566235 0.85 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4MGLL
SCHEMBL47407 0.82 ALDH1A1 (0.49) ALDH1A1TSHRMAPK1TP53CYP3A4
SCHEMBL13431263 0.79 TSHR (0.53) ALDH1A1TSHRMAPK1TP53CYP3A4
SCHEMBL20024446 0.76 HMGCR (0.35) ALDH1A1TSHRMAPK1TP53CYP3A4
SCHEMBL20024454 0.76 HMGCR (0.32) ALDH1A1
SCHEMBL13655650 0.76 ALDH1A1 (0.38) ALDH1A1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230236505-A1 NEGATIVE PHOTOSENSITIVE RESIN COMPOSITION, PATTERN FORMATION METHOD, AND LAMINATED FILM SAN-APRO LTD. (JP) 2023-07-27 US disclosed
US-20180095366-A1 NEGATIVE PHOTOSENSITIVE COMPOSITION AND PATTERN FORMATION METHOD TOKYO OHKA KOGYO CO., LTD. (JP) 2018-04-05 US disclosed