SCHEMBL27437397

SCHEMBL27437397

CC(C)C(=O)C(C)C(=O)OC(C1CCCCC1)C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
MMP2 P08253 2/20 0.34
CA9 Q16790 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 3/20 0.33
TSHR P16473 1/20 0.33
TP53 P04637 1/20 0.33
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
OPRK1 P41145 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CTSK P43235 1/20 0.31
SCN1A P35498 1/20 0.31

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
SCHEMBL9608683 0.85 EPHX1 (0.39) EPHX1CA12CA1CA2MMP2
SCHEMBL21396663 0.79 EPHX1 (0.33) EPHX1CA12CA1CA2MMP2
SCHEMBL27437350 0.76 EPHX1 (0.35) EPHX1CA12CA1CA2MMP2
SCHEMBL8295291 0.74 TSHR (0.35) TSHR
SCHEMBL9609345 0.72 TSHR (0.44) EPHX1CA12CA1CA2MMP2
SCHEMBL27436900 0.72 CA12 (0.33) EPHX1CA12CA1CA2MMP2
SCHEMBL20943419 0.72 EPHX1 (0.44) EPHX1SMN1; SMN2ALDH1A1TP53NPC1
SCHEMBL5944256 0.72 EPHX1 (0.38) EPHX1CA12CA1CA2MMP2
SCHEMBL30457985 0.71 EPHX1 (0.40) EPHX1CA12CA1CA2MMP2
SCHEMBL2381945 0.71 EPHX1 (0.40) EPHX1CA12CA1CA2MMP2

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-12032290-B2 Actinic ray-sensitive or radiation-sensitive resin composition, resist film, pattern forming method, and method for manufacturing electronic device FUJIFILM CORPORATION (JP) 2024-07-09 US disclosed