SCHEMBL8527784

SCHEMBL8527784

CON=C(C(=O)N(C)Cc1cc(C2(C)CCc3ccccc32)ccc1O)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 3/20 0.33
TACR2 P21452 1/20 0.32
TACR1 P25103 1/20 0.32
TACR3 P29371 1/20 0.32
LMNA P02545 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL8530488 0.72 HDAC9 (0.33) PIN1TACR1TACR3LMNATDP1
SCHEMBL8527009 0.70 SLC6A4 (0.35)
SCHEMBL8526541 0.70 KMT2A (0.34) PIN1
SCHEMBL8530606 0.70 KIF11 (0.35) LMNA
SCHEMBL8529282 0.69 KIF11 (0.34)
SCHEMBL28843586 0.67 SMN1; SMN2 (0.38) LMNA
SCHEMBL27795570 0.66 GAA (0.38) LMNA
SCHEMBL31209958 0.64 GAA (0.36) LMNATDP1
SCHEMBL27832247 0.64 TSHR (0.42) LMNA
SCHEMBL8537307 0.64 TSHR (0.42) LMNA

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-5739140-A AGRICULTURAL FUNGICIDES MONSANTO COMPANY (US) 1998-04-14 US disclosed