SCHEMBL21074754

SCHEMBL21074754

CCC1CCCCC1C(C)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
GBA1 P04062 1/20 0.33
PTGS1 P23219 7/20 0.30
PTGS2 P35354 6/20 0.30
MT-CO1 P00395 1/20 0.30
MT-CO2 P00403 1/20 0.30
SHBG P04278 1/20 0.30

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
SCHEMBL12462658 0.82 PABPC1 (0.37) CA1CA2CA4GBA1PTGS1
SCHEMBL14639770 0.82 CA1 (0.40) CA1CA2CA4IDO1TDO2
SCHEMBL19906495 0.81 CA1 (0.38) CA1CA2CA4IDO1TDO2
SCHEMBL16191651 0.81 CA1 (0.38) CA1CA2CA4IDO1TDO2
SCHEMBL3479985 0.81 GBA1 (0.38) CA1CA2CA4IDO1TDO2
SCHEMBL23797124 0.77 CA1 (0.35) CA1CA2CA4SHBG
SCHEMBL19464310 0.77 CA1 (0.35) CA1CA2CA4SHBG
SCHEMBL14781411 0.77 CA1 (0.35) CA1CA2CA4SHBG
SCHEMBL349547 0.77 GBA1 (0.42) CA1CA2CA4GBA1
SCHEMBL5663911 0.76 CA1 (0.33) CA1CA2CA4IDO1TDO2

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
EP-3537217-A2 POSITIVE RESIST COMPOSITION, RESIN USED FOR THE POSITIVE RESIST COMPOSITION, COMPOUND USED FOR SYNTHESIS OF THE RESIN AND PATTERN FORMING METHOD USING THE POSITIVE RESIST COMPOSITION FUJIFILM Corporation (JP) 2019-09-11 EP disclosed
EP-1795960-B1 Positive resist composition, pattern forming method using the positive resist composition, use of the positive resit composition FUJIFILM CORP (JP) 2019-06-05 EP disclosed