SCHEMBL20903409

SCHEMBL20903409

CP(C)CC(C)(C)CNC(=O)CCCO

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.36
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NAAA Q02083 1/20 0.33
MAPT P10636 1/20 0.33
CNR1 P21554 3/20 0.33
GAA P10253 1/20 0.33
FAAH O00519 2/20 0.32
PTPN1 P18031 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CAMK2A Q9UQM7 1/20 0.31
PTGS1 P23219 1/20 0.31
KCNH2 Q12809 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
SCHEMBL11520316 0.77 RECQL (0.41) RECQLALDH1A1TSHRNAAAMAPT
Oxalic Acid SCHEMBL9795310 0.76 KDM4E (0.36) RECQLALDH1A1HTTNAAACNR1
SCHEMBL4026110 0.76 RECQL (0.39) RECQLALDH1A1TSHRNAAACNR1
SCHEMBL9498341 0.75 RECQL (0.40) RECQLALDH1A1HTTTSHRSMN1; SMN2
SCHEMBL11519140 0.72 RECQL (0.39) RECQLTSHRSMN1; SMN2NAAAMAPT
SCHEMBL9500008 0.70 RECQL (0.42) RECQLALDH1A1TSHRSMN1; SMN2NAAA
Hydrochloric Acid SCHEMBL28865405 0.69 KDM4E (0.38) RECQLTSHRSMN1; SMN2NAAAMAPT
SCHEMBL11242257 0.68 FAAH (0.58) ALDH1A1NAAAMAPTCNR1FAAH
SCHEMBL3465689 0.68
SCHEMBL21559869 0.67 NAAA (0.50) ALDH1A1TSHRNAAACNR1FAAH

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
EP-3470051-A1 COSMETIC BASE INCLUDING AMIDE ALCOHOL, AND COSMETIC Kokyu Alcohol Kogyo Co., Ltd. (JP) 2019-04-17 EP disclosed