SCHEMBL11056072

SCHEMBL11056072

COc1ccc(-c2ccccc2C2NC(=O)NC2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 2/20 0.48
HPGD P15428 2/20 0.48
CASP1 P29466 1/20 0.48
MPI P34949 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
ABL1 P00519 2/20 0.43
ABCB1 P08183 1/20 0.43
BCR P11274 1/20 0.43
TP53 P04637 3/20 0.42
TNKS2 Q9H2K2 1/20 0.42
PTPN1 P18031 1/20 0.41
CCNE2 O96020 1/20 0.41
CDK4 P11802 1/20 0.41

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
SCHEMBL11068574 0.81 ABL1 (0.43) MAPTALDH1A1KDM4EHPGDABL1
SCHEMBL8595564 0.76 POLB (0.63) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30550385 0.76 POLB (0.63) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7167696 0.76 ALDH1A1 (0.67) MAPTALDH1A1KDM4EHPGDCASP1
SCHEMBL11653846 0.72 ALOX15 (0.59) MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL11650712 0.72 LMNA (0.56) MAPTALDH1A1KDM4EHPGDCYP3A4
SCHEMBL11649213 0.71 GAA (0.48) MAPTALDH1A1KDM4ETP53TSHR
SCHEMBL11644988 0.71 ALOX15 (0.46) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL11060023 0.71 ALDH1A1 (0.48) MAPTALDH1A1KDM4EHSD17B10CYP3A4
SCHEMBL20681467 0.71 TNKS2 (0.60) MAPTALDH1A1KDM4EHPGDCASP1

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-4486344-A CARBONYLDIIMIDAZOLE AS LINKING AGENT, IMMUNOASSY MILES LABORATORIES, INC. (US) 1984-12-04 US disclosed
EP-0123114-A1 Urea-linked immunogens, antibodies, and preparative method MILES LABORATORIES, INC. (US) 1984-10-31 EP disclosed