SCHEMBL13014304

SCHEMBL13014304

COc1cnc2cccc(C(O)CN3CCC(NC(=O)c4ccc5c(c4)NC(=O)CS5)CC3)c2c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 8/20 0.55
HPGD P15428 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
DRD4 P21917 1/20 0.40
MCHR1 Q99705 1/20 0.40

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
SCHEMBL13014311 0.87 SLC2A1 (0.49) SLC2A1
SCHEMBL3772133 0.87 KCNH2 (0.52) SLC2A1
SCHEMBL13014300 0.86 SLC2A1 (0.55) SLC2A1
SCHEMBL13014330 0.86 SLC2A1 (0.42) SLC2A1KMT2AMCHR1
SCHEMBL3771337 0.84 MAOA (0.39) SLC2A1
SCHEMBL3773354 0.84 SLC2A1 (0.51) SLC2A1
SCHEMBL6111528 0.84 SLC2A1 (0.51) SLC2A1
SCHEMBL14541341 0.83 KMT2A (0.42) SLC2A1HPGDKMT2AMEN1NPC1
SCHEMBL3780496 0.81 SLC2A1 (0.52) SLC2A1
SCHEMBL13014338 0.81 SLC2A1 (0.60) SLC2A1NPC1RAB9ADRD4

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-20100324030-A1 5-Quinoline derivatives having an anti-bacterial activity MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2010-12-23 US disclosed
US-20100324030-A1 5-Quinoline derivatives having an anti-bacterial activity MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2010-12-23 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-20100324030-A1 5-Quinoline derivatives having an anti-bacterial activity TOP2A, TOP1, TOP2B SLC2A1 4605/4885HPGD 670/4885KMT2A 2291/4885

“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.