SCHEMBL30799232

SCHEMBL30799232

Cc1cc(C)cc(C(=O)C2CCc3ccccc32)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 9/20 0.57
LMNA P02545 2/20 0.47
PPIA P62937 3/20 0.44
PPIB P23284 2/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PPID Q08752 2/20 0.42
KCNQ2 O43526 1/20 0.41
ANO1 Q5XXA6 2/20 0.41
OPRM1 P35372 1/20 0.41
OPRK1 P41145 1/20 0.41
PPIL1 Q9Y3C6 1/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
PDPK1 O15530 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40

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
SCHEMBL28002431 0.82 PIN1 (0.66) PIN1PPIAPPIBPPIDKCNQ2
SCHEMBL30799263 0.78 PIN1 (0.70) PIN1PPIAPPIBALDH1A1HPGD
SCHEMBL30799226 0.77 PIN1 (0.56) PIN1PPIAPPIBALDH1A1HPGD
SCHEMBL30799420 0.77 PIN1 (0.48) PIN1LMNAPPIAPPIB
SCHEMBL30799449 0.77 PIN1 (0.48) PIN1LMNA
SCHEMBL8848989 0.76 PIN1 (0.58) PIN1KCNQ2ANO1PDPK1TAS1R3
SCHEMBL4742598 0.76 PIN1 (0.58) PIN1KCNQ2ANO1PDPK1TAS1R3
SCHEMBL12733130 0.76 PIN1 (0.77) PIN1PPIAPPIBPPIDKCNQ2
SCHEMBL27914888 0.76 PIN1 (0.59) PIN1LMNAALDH1A1OPRM1OPRK1
SCHEMBL25642142 0.76 PIN1 (0.59) PIN1LMNAALDH1A1OPRM1OPRK1

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
CN-115894141-B Method for synthesizing acyl indene alkane derivative 贺州学院 2023-12-22 CN disclosed