SCHEMBL11575221

SCHEMBL11575221

NC(=O)CC[C@H](N)C(=O)c1ccccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.48
HPGD P15428 4/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 3/20 0.48
MAPT P10636 2/20 0.48
HSD17B10 Q99714 1/20 0.48
ALOX15 P16050 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
KMT2A Q03164 1/20 0.44
CA1 P00915 2/20 0.44
CA9 Q16790 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
CA12 O43570 1/20 0.41
CA2 P00918 1/20 0.41
HMGB1 P09429 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA7 P43166 1/20 0.41
NAPRT Q6XQN6 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
SCHEMBL11575219 1.00 KDM4E (0.48) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL726909 0.87 KDM4E (0.46) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL29524852 0.83 KDM4E (0.52) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL11179021 0.79 KDM4E (0.50) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL8231314 0.78 FPR1 (0.44) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL30426487 0.78 FPR1 (0.44) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL10824784 0.77 KDM4E (0.48) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL8411467 0.77 KDM4E (0.48) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL8411463 0.77 KDM4E (0.48) KDM4EHPGDALDH1A1TSHRMAPT
SCHEMBL29634956 0.77 BLM (0.53) ALDH1A1TSHRMAPTHSD17B10ALOX15

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
JP-53113032-A None JP disclosed
JP-S53113032-A IMMUNE DEPRESANTS MITSUBISHI CHEM IND LTD 1978-10-03 JP disclosed