SCHEMBL30786011

SCHEMBL30786011

COCC(O)CNCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
ADRA1A P35348 1/20 0.43
PRMT1 Q99873 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
FFAR1 O14842 1/20 0.41
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 2/20 0.39
LMNA P02545 1/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
MAPT P10636 1/20 0.38
CYP1A2 P05177 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL29169677 0.88 ALDH1A1 (0.40) ALDH1A1ADRA1APRMT1FFAR4FFAR1
SCHEMBL23095680 0.87 KDM4E (0.40) ALDH1A1KDM4EKMT2AMAPTADRB2
SCHEMBL28466833 0.85 CYP3A4 (0.37) ALDH1A1KDM4EKMT2ATSHRMAPT
SCHEMBL22729319 0.84 KDM4E (0.39) ALDH1A1KDM4EKMT2ATSHRMAPT
SCHEMBL4149074 0.82 KDM4E (0.41) ALDH1A1KDM4EKMT2ATSHRMAPT
SCHEMBL4140218 0.82 KDM4E (0.41) ALDH1A1KDM4EKMT2ATSHRMAPT
SCHEMBL10079186 0.81 FFAR4 (0.49) ALDH1A1ADRA1APRMT1FFAR4FFAR1
SCHEMBL28466832 0.81 KDM4E (0.36) ALDH1A1KDM4EKMT2ALMNA
SCHEMBL22729315 0.80 KDM4E (0.42) ALDH1A1KDM4EKMT2ATSHRMAPT
SCHEMBL29169706 0.80 ANPEP (0.45) ALDH1A1KDM4EKMT2ATSHRMAPT

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
CN-111770767-B Extracorporeal device and matrix for removing plasmin from biological fluids, method and use thereof 普拉斯富瑞有限公司 2024-03-05 CN disclosed