SCHEMBL3303285

SCHEMBL3303285

COc1ccc(C)cc1NC(=O)Nc1ccc(C2CCC(C(=O)O)CC2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.51
MEN1 O00255 8/20 0.51
MAPT P10636 5/20 0.51
ALDH1A1 P00352 4/20 0.51
PDE4A P27815 1/20 0.49
PDE4B Q07343 1/20 0.49
PDE4C Q08493 1/20 0.49
PDE4D Q08499 1/20 0.49
RAB9A P51151 1/20 0.47
CASP3 P42574 2/20 0.47
SENP7 Q9BQF6 2/20 0.47
TP53 P04637 2/20 0.47
SENP6 Q9GZR1 1/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TSHR P16473 1/20 0.44

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
SCHEMBL3303281 1.00 KMT2A (0.51) KMT2AMEN1MAPTALDH1A1PDE4A
SCHEMBL3301411 0.89 KMT2A (0.51) KMT2AMEN1MAPTALDH1A1PDE4A
SCHEMBL3301417 0.89 KMT2A (0.51) KMT2AMEN1MAPTALDH1A1PDE4A
SCHEMBL13389840 0.88 KMT2A (0.51) KMT2AMEN1MAPTALDH1A1PDE4A
SCHEMBL14113707 0.88 KMT2A (0.51) KMT2AMEN1MAPTALDH1A1PDE4A
SCHEMBL3302704 0.88 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1RAB9A
SCHEMBL3302702 0.88 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1RAB9A
SCHEMBL14113715 0.88 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1RAB9A
SCHEMBL14113558 0.86 KMT2A (0.63) KMT2AMEN1MAPTALDH1A1PDE4A
SCHEMBL3298768 0.86 KMT2A (0.63) KMT2AMEN1MAPTALDH1A1PDE4A

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-20100093733-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES PROSIDION LIMITED (GB) 2010-04-15 US disclosed
WO-2008099221-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES PROSIDION LIMITED (GB) 2008-08-21 WO 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 KMT2A 1665/4885MEN1 2505/4885MAPT 1308/4885

“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.