SCHEMBL10905757

SCHEMBL10905757

CCCC(=O)N(CCCC(=O)O)N(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.46
▸ FFAR3 O14843 1/20 0.46
▸ HDAC3 O15379 1/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ HDAC2 Q92769 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ KDM5A P29375 1/20 0.46
▸ KDM4C Q9H3R0 1/20 0.46
▸ GPR84 Q9NQS5 7/20 0.45
▸ PPARG P37231 7/20 0.45
▸ PPARD Q03181 7/20 0.45
▸ PPARA Q07869 7/20 0.45
▸ HDAC11 Q96DB2 5/20 0.45
▸ TSHR P16473 4/20 0.45
▸ PTPN1 P18031 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ TLR2 O60603 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ FABP4 P15090 2/20 0.45
▸ SLC22A6 Q4U2R8 1/20 0.45

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
SCHEMBL10906605 0.89 AKR1B1 (0.59) AKR1B1KDM5AKDM4CGPR84PPARG
SCHEMBL10905768 0.87 GPR84 (0.61) AKR1B1KDM5AKDM4CGPR84PPARG
SCHEMBL10907491 0.87 GPR84 (0.61) AKR1B1KDM5AKDM4CGPR84PPARG
SCHEMBL10905695 0.85 AKR1B1 (0.59) AKR1B1KDM5AKDM4CGPR84PPARG
SCHEMBL10903601 0.84 CAMK2A (0.44) AKR1B1KDM5AKDM4CGPR84TSHR
SCHEMBL10903599 0.79 LMNA (0.42) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL10903614 0.78 LMNA (0.40) AKR1B1HDAC3HDAC1HDAC2HDAC8
SCHEMBL10903589 0.77 ABCC4 (0.38) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL1310513 0.76 GPR84 (0.50) AKR1B1KDM5AKDM4CGPR84PPARG
SCHEMBL1309401 0.76 GPR84 (0.50) AKR1B1KDM5AKDM4CGPR84PPARG

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-4633014-A ANTIARRHYTHMIA AGENTS INSTITUT ORGANICHESKOGO SINTEZA AKADEMII NAUK LATVIISKOI SSR 1986-12-30 — — US disclosed
Send feedback