SCHEMBL11050299

SCHEMBL11050299

CCOC(=O)C(Cl)CC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.46
ALDH1A1 P00352 7/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HSD17B10 Q99714 2/20 0.39
CHRM1 P11229 1/20 0.39
ADORA1 P30542 1/20 0.39
CAD P27708 1/20 0.38
LMNA P02545 1/20 0.37
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
SOAT1 P35610 1/20 0.36
HPGD P15428 1/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
KMT2A Q03164 1/20 0.34
CPB2 Q96IY4 1/20 0.33

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
SCHEMBL11051394 0.80 SMN1; SMN2 (0.36) ALOX15ALDH1A1CYP3A4TSHRTDP1
SCHEMBL28160177 0.80 ALDH1A1 (0.44) ALOX15ALDH1A1CYP3A4TSHRTDP1
SCHEMBL8307598 0.80 ALDH1A1 (0.41) ALOX15ALDH1A1CYP3A4TSHRTDP1
SCHEMBL6809972 0.80 ALDH1A1 (0.53) ALOX15ALDH1A1CYP3A4TSHRTDP1
SCHEMBL6806491 0.80 ALDH1A1 (0.53) ALOX15ALDH1A1CYP3A4TSHRTDP1
SCHEMBL8308112 0.80 ALDH1A1 (0.53) ALOX15ALDH1A1CYP3A4TSHRTDP1
SCHEMBL7521267 0.77 ALOX15 (0.50) ALOX15ALDH1A1TDP1HSD17B10CAD
SCHEMBL10972712 0.77
SCHEMBL11050300 0.77 ALDH1A1 (0.39) ALOX15ALDH1A1CYP3A4TSHRTDP1
SCHEMBL11147040 0.77 ALDH1A1 (0.41) ALOX15ALDH1A1CYP3A4TSHRTDP1

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-4465844-A PEPTIDE, GERMICIDE, DISINFECTANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-08-14 US disclosed
US-4436918-A FROM A 2,5-DIOXOPYRROLIDINE COMPOUND TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-03-13 US disclosed