SCHEMBL7760858

SCHEMBL7760858

CCCCCCCCCC(=O)OC1(c2ccccc2C(=O)OC(CC)CC)C=CC(C(=O)O)C=C1F

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 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
SCHEMBL8198692 0.90 ALDH1A1 (0.48) ALDH1A1KDM4EMEN1RECQLKMT2A
SCHEMBL8201148 0.88 ALDH1A1 (0.46) ALDH1A1KDM4ETSHRLMNA
SCHEMBL8200467 0.88 ALDH1A1 (0.41) ALDH1A1KDM4EMEN1RECQLKMT2A
SCHEMBL8201025 0.88 ALDH1A1 (0.46) ALDH1A1KDM4ETSHRLMNA
SCHEMBL8190499 0.88 ALDH1A1 (0.46) ALDH1A1KDM4ETSHRLMNA
SCHEMBL8611827 0.78 ALDH1A1 (0.50) ALDH1A1KDM4EMEN1RECQLKMT2A
SCHEMBL10397748 0.75 PRSS1 (0.39) ALDH1A1KDM4EPRSS1PRSS2PRSS3
SCHEMBL8198638 0.75 ALDH1A1 (0.48) ALDH1A1KDM4EMEN1RECQLKMT2A
SCHEMBL8190258 0.73 ALDH1A1 (0.53) ALDH1A1KDM4EMEN1RECQLKMT2A
SCHEMBL8201146 0.73 ALDH1A1 (0.53) ALDH1A1KDM4EMEN1RECQLKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0829468-B1 Swallow-tailed compound and ferrielectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL CO (JP) 2001-06-13 EP disclosed
US-5938973-A MIXTURE OF 4-ALKYLCARBONYLOXYBENZOIC ACID ESTER AND 4-ALKYLOXY-4*-BIPHENYLCARBOXYLIC ESTER DERIVATIVES MITSUBISHI GAS CHEMICAL COMPANY (JP) 1999-08-17 US disclosed
EP-0829468-A1 Swallow-tailed compound and ferrielectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1998-03-18 EP disclosed