SCHEMBL13638225

SCHEMBL13638225

COC(=O)C1C(C)CC(C)C1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PPM1B O75688 1/20 0.50
▸ PTPN1 P18031 1/20 0.50
▸ PPP1CC P36873 1/20 0.50
▸ POLB P06746 2/20 0.43
▸ CYP2C19 P33261 2/20 0.39
▸ PPP5C P53041 1/20 0.38
▸ CHRNB2 P17787 2/20 0.35
▸ CHRNA4 P43681 2/20 0.35
▸ CHRNB4 P30926 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35
▸ CHRNA7 P36544 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.34
▸ TDP1 Q9NUW8 1/20 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
SCHEMBL18461072 0.91 CYP2C19 (0.45) PPM1BPTPN1PPP1CCCYP2C19CHRNB2
SCHEMBL28287653 0.87 PPM1B (0.60) PPM1BPTPN1PPP1CCPOLBCYP2C19
SCHEMBL24597716 0.83 PPP5C (0.48) POLBCYP2C19PPP5CALDH1A1MEN1
SCHEMBL3147145 0.78 — —
SCHEMBL28784764 0.78 PPP5C (0.35) PPP5CCHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL12765015 0.77 CYP2C19 (0.42) PPM1BPTPN1PPP1CCCYP2C19CHRNB2
SCHEMBL20995893 0.77 PPM1B (0.52) PPM1BPTPN1PPP1CCPOLBCYP2C19
SCHEMBL13517364 0.76 PPM1B (0.44) PPM1BPTPN1PPP1CCPOLBCYP2C19
SCHEMBL257600 0.76 PPM1B (0.56) PPM1BPTPN1PPP1CCPOLBCYP2C19
SCHEMBL8917467 0.76 PPM1B (0.56) PPM1BPTPN1PPP1CCPOLBCYP2C19

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-7611820-B2 Positive resist composition and pattern-forming method using the same FUJIFILM CORPORATION (JP) 2009-11-03 — — US disclosed
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