SCHEMBL9864083

SCHEMBL9864083

CCCCC(CC1CCCO1)C(=O)OO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTR2A P28223 5/20 0.39
CYP3A4 P08684 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD1 P21728 1/20 0.39
SLC6A4 P31645 1/20 0.39
OPRM1 P35372 1/20 0.39
DRD3 P35462 1/20 0.39
KMT2A Q03164 1/20 0.39
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
TP53 P04637 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
SCHEMBL9863708 0.86 LMNA (0.45) LMNAPOLBALDH1A1
SCHEMBL9876466 0.85 LMNA (0.44) LMNAPOLB
SCHEMBL9863828 0.85 LMNA (0.44) LMNAPOLB
SCHEMBL9863565 0.85 LMNA (0.44) LMNAPOLB
SCHEMBL2939732 0.80 USP2 (0.41) LMNAPOLBUSP2SMN1; SMN2MEN1
SCHEMBL29191695 0.80 GRIK1 (0.43) LMNAPOLBUSP2SMN1; SMN2TP53
SCHEMBL20787067 0.79 TSHR (0.38) LMNAPOLBUSP2SMN1; SMN2HTR2A
SCHEMBL28942381 0.78 MEN1 (0.40) MEN1KMT2AALDH1A1HPGD
SCHEMBL759963 0.73 SLC6A5 (0.40) MEN1KMT2AALDH1A1HPGD
SCHEMBL759964 0.73 SLC6A5 (0.40) MEN1KMT2AALDH1A1HPGD

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-5015524-A Lens sheet MITSUBISHI RAYON COMPANY, LTD. (JP) 1991-05-14 US disclosed
EP-0376254-A2 Lens sheet MITSUBISHI RAYON CO., LTD. (JP) 1990-07-04 EP disclosed