SCHEMBL9658680

SCHEMBL9658680

C[C@H](N)C(=O)c1[c]c2ccccc2cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.37
EPHX1 P07099 1/20 0.35
XIAP P98170 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
GAA P10253 2/20 0.31
NCEH1 Q6PIU2 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
BIRC2 Q13490 1/20 0.31
UGT2B7 P16662 1/20 0.31
LARS1 Q9P2J5 1/20 0.31
IDO1 P14902 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9658676 1.00 ELANE (0.37) ELANEEPHX1XIAPTAAR1HTR2A
SCHEMBL758982 0.78 ALDH1A1 (0.38) GAANCEH1KDM4EALDH1A1CYP1A2
SCHEMBL1181527 0.78 PARP1 (0.41) GAAKDM4EALDH1A1
SCHEMBL22263726 0.77 KDM4E (0.44) KDM4EALDH1A1CYP1A2RAB9ASMN1; SMN2
SCHEMBL49732 0.76 MGAM (0.42) KDM4EALDH1A1CYP1A2IDO1SMN1; SMN2
SCHEMBL12984354 0.74 SMN1; SMN2 (0.38) GAAKDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL2167038 0.74 TSHR (0.42) NCEH1KDM4EALDH1A1
SCHEMBL294061 0.73 ALDH1A1 (0.53) GAAKDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL1127740 0.71 ALDH1A1 (0.46) GAAALDH1A1RAB9A
SCHEMBL7883312 0.71 SMN1; SMN2 (0.41) KDM4EALDH1A1CYP1A2RAB9ASMN1; SMN2

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-5096949-A Heat and oxidation resistance, photostability; polyolefins; uv rad THE B. F. GOODRICH COMPANY (US) 1992-03-17 US disclosed
US-4920228-A N,N-disubstituted, α-(3,5-dialkyl-4-hydroxyphenyl)-α,α-disubstituted acetamides and composition stabilized therewith THE B. F. GOODRICH COMPANY (US) 1990-04-24 US disclosed