SCHEMBL3300701

SCHEMBL3300701

O=C(Nc1ccc([C@H]2CC[C@H](C(=O)O)CC2)cc1)c1ccc2ccccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 1/20 0.58
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
NR1H4 Q96RI1 1/20 0.55
HDAC3 O15379 2/20 0.54
HDAC11 Q96DB2 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
RAB9A P51151 7/20 0.54
NPC1 O15118 6/20 0.54
CASP3 P42574 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
KDM4E B2RXH2 1/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
MCL1 Q07820 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
GPR27 Q9NS67 1/20 0.52
PLAU P00749 2/20 0.51
ENPP3 O14638 1/20 0.51

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
SCHEMBL3300711 1.00 DEGS1 (0.58) DEGS1KMT2AMEN1NR1H4HDAC3
SCHEMBL14113698 1.00 DEGS1 (0.58) DEGS1KMT2AMEN1NR1H4HDAC3
SCHEMBL3302674 0.88 HDAC3 (0.52) DEGS1KMT2AMEN1HDAC3HDAC11
SCHEMBL3302670 0.88 HDAC3 (0.52) DEGS1KMT2AMEN1HDAC3HDAC11
SCHEMBL3307328 0.88 HDAC3 (0.55) DEGS1KMT2AMEN1NR1H4HDAC3
SCHEMBL3307317 0.88 HDAC3 (0.55) DEGS1KMT2AMEN1NR1H4HDAC3
SCHEMBL14113697 0.88 HDAC3 (0.52) DEGS1KMT2AMEN1HDAC3HDAC11
SCHEMBL3303343 0.86 PLAU (0.61) KMT2AMEN1HDAC3HDAC11HDAC8
SCHEMBL3303339 0.86 PLAU (0.61) KMT2AMEN1HDAC3HDAC11HDAC8
SCHEMBL14113700 0.86 PLAU (0.61) KMT2AMEN1HDAC3HDAC11HDAC8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100093733-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES PROSIDION LIMITED (GB) 2010-04-15 US disclosed
US-20100093733-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES PROSIDION LIMITED (GB) 2010-04-15 US disclosed
US-20100093733-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES PROSIDION LIMITED (GB) 2010-04-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100093733-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES CPS1, GOT2, GPR119 DEGS1 989/4885KMT2A 1665/4885MEN1 2505/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.