SCHEMBL6387474

SCHEMBL6387474

CCCC(CCC(=O)O)(C(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
CYP1A2 P05177 1/20 0.48
THRB P10828 1/20 0.48
FFAR3 O14843 2/20 0.48
HDAC3 O15379 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
AKR1B1 P15121 1/20 0.42
NAALAD2 Q9Y3Q0 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 7/20 0.41
PPARD Q03181 7/20 0.41
PPARA Q07869 7/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
PTPN1 P18031 3/20 0.41
TLR2 O60603 2/20 0.41

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
SCHEMBL4810549 0.87 LMNA (0.47) ALDH1A1KMT2AMEN1CYP1A2THRB
SCHEMBL1031267 0.87 FFAR3 (0.38) ALDH1A1KMT2AMEN1CYP1A2THRB
Hydrochloric Acid SCHEMBL809273 0.85 FFAR3 (0.36) ALDH1A1KMT2AMEN1CYP1A2THRB
SCHEMBL21269954 0.85 FFAR3 (0.36) ALDH1A1KMT2AMEN1CYP1A2THRB
SCHEMBL21269884 0.85 FFAR3 (0.36) ALDH1A1KMT2AMEN1CYP1A2THRB
SCHEMBL28314587 0.85 FFAR3 (0.36) ALDH1A1KMT2AMEN1CYP1A2THRB
SCHEMBL21269721 0.85 FFAR3 (0.36) ALDH1A1KMT2AMEN1CYP1A2THRB
SCHEMBL9132408 0.85 AKR1B1 (0.54) ALDH1A1KMT2AMEN1CYP1A2AKR1B1
SCHEMBL11305844 0.83 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1CYP1A2THRB
SCHEMBL8968104 0.83 GPR84 (0.56) ALDH1A1KMT2AMEN1AKR1B1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1367077-B1 CURABLE COMPOSITION ASAHI CHEMICAL IND (JP) 2005-09-07 EP disclosed
US-20040059085-A1 Curable composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2004-03-25 US disclosed
CN-1484662-A Curable composition ������������ʽ���� 2004-03-24 CN disclosed
EP-1367077-A1 CURABLE COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2003-12-03 EP disclosed