SCHEMBL10144052

SCHEMBL10144052

O=C(C1CCCCC1)N1CCCc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 1.00
TSHR P16473 4/20 0.72
SMN1; SMN2 Q16637 3/20 0.64
LMNA P02545 2/20 0.62
HTT P42858 1/20 0.62
NOTUM Q6P988 1/20 0.60
RAB9A P51151 2/20 0.58
BRD4 O60885 1/20 0.58
ATAD2 Q6PL18 1/20 0.58
NPC1 O15118 1/20 0.58
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
USP2 O75604 1/20 0.55
SIGMAR1 Q99720 1/20 0.55

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
SCHEMBL14156261 0.92 POLB (0.86) POLBTSHRSMN1; SMN2LMNANOTUM
SCHEMBL27353989 0.84 TSHR (1.00) POLBTSHRLMNAHTTNOTUM
SCHEMBL21788621 0.84 POLB (0.71) POLBTSHRSMN1; SMN2LMNAHTT
SCHEMBL698692 0.80 POLB (0.67) POLBTSHRSMN1; SMN2LMNAHTT
SCHEMBL3092095 0.80 POLB (0.65) POLBTSHRSMN1; SMN2LMNANOTUM
SCHEMBL4019697 0.79 SMN1; SMN2 (0.79) POLBTSHRSMN1; SMN2HTTNOTUM
SCHEMBL4758824 0.78 LMNA (1.00) POLBTSHRSMN1; SMN2LMNAHTT
SCHEMBL12685845 0.78 TSHR (0.80) POLBTSHRLMNAHTTNOTUM
SCHEMBL29445653 0.78 TSHR (0.80) POLBTSHRLMNAHTTNOTUM
SCHEMBL3330822 0.77 POLB (0.63) POLBTSHRSMN1; SMN2LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 POLB 2362/4885TSHR 2802/4885SMN1; SMN2 4780/4885

“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.