SCHEMBL7699006

SCHEMBL7699006

C=C(CC(CC)CCCC)C(=O)O.C=C(Cc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.49
ALDH1A1 P00352 3/20 0.45
CA2 P00918 1/20 0.45
CYP3A4 P08684 1/20 0.45
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HDAC3 O15379 4/20 0.40
HDAC1 Q13547 4/20 0.40
HDAC2 Q92769 4/20 0.40
HDAC8 Q9BY41 4/20 0.40
HDAC6 Q9UBN7 4/20 0.40
HDAC4 P56524 3/20 0.40
HDAC7 Q8WUI4 3/20 0.40
HDAC10 Q969S8 3/20 0.40
HDAC11 Q96DB2 3/20 0.40
HDAC9 Q9UKV0 3/20 0.40
HDAC5 Q9UQL6 3/20 0.40
POLB P06746 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 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
SCHEMBL6131025 0.88 HDAC3 (0.45) CNR2ALDH1A1CA2CYP3A4LMNA
SCHEMBL22081 0.85 CA2 (0.47) ALDH1A1CA2CYP3A4MAPK1TSHR
SCHEMBL20609791 0.85 CA2 (0.47) ALDH1A1CA2CYP3A4MAPK1TSHR
SCHEMBL11525978 0.85 ALDH1A1 (0.44) ALDH1A1CA2CYP3A4LMNAKDM4E
SCHEMBL6131024 0.85 ALDH1A1 (0.40) CNR2ALDH1A1CA2CYP3A4LMNA
SCHEMBL6131027 0.85 ALDH1A1 (0.40) CNR2ALDH1A1CA2CYP3A4LMNA
SCHEMBL10896917 0.84 TRPA1 (0.46) ALDH1A1HDAC3HDAC1HDAC2HDAC8
Styrene SCHEMBL2045081 0.84 ALDH1A1 (0.43) ALDH1A1CA2CYP3A4LMNAKDM4E
Ethylene SCHEMBL1759446 0.83 CA2 (0.46) ALDH1A1CA2CYP3A4MAPK1TSHR
Methacrylic Acid SCHEMBL9065134 0.81 CA2 (0.43) ALDH1A1CA2CYP3A4MAPK1TSHR

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
US-6475697-B2 MULTILAYER; SUPPORT, SILVER HALIDE EMULSION, REDUCING AGENT, SUBBING AGENT AND BINDER KONICA CORPORATION (JP) 2002-11-05 US disclosed
US-20010038981-A1 Photothermographic dry imaging material easy to separate emulsion layer from support and method for separation KONICA CORPORATION (JP) 2001-11-08 US disclosed