SCHEMBL8102223

SCHEMBL8102223

COC(=O)c1ccc(NC(=O)c2ccccc2CN2CCC(Oc3cc(C)nc4c(F)cccc34)CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TP53 P04637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
ADORA2A P29274 1/20 0.39
POLB P06746 3/20 0.39
ALDH1A1 P00352 2/20 0.39
SIRT2 Q8IXJ6 3/20 0.39
ABL1 P00519 2/20 0.38
KIT P10721 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
DRD4 P21917 1/20 0.38
LCK P06239 1/20 0.37
CSF1R P07333 1/20 0.37
PDGFRB P09619 1/20 0.37
BLK P51451 1/20 0.37
DDR1 Q08345 1/20 0.37
DDR2 Q16832 1/20 0.37

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
SCHEMBL13945410 0.93 MEN1 (0.39) LMNAMAPTMEN1KMT2ATP53
SCHEMBL13968360 0.90 OPRL1 (0.42) MAPTMEN1KMT2ATP53ALDH1A1
SCHEMBL8091662 0.84 HRH1 (0.47) KMT2AALDH1A1DRD4
SCHEMBL8095680 0.81 PDE4B (0.46) MEN1KMT2APOLBALDH1A1
SCHEMBL8097090 0.79 DRD4 (0.37) MEN1KMT2ADRD4
SCHEMBL8094650 0.78 LMNA (0.40) LMNAMEN1KMT2ADRD4
SCHEMBL13945353 0.77 S1PR5 (0.43) POLBALDH1A1
SCHEMBL4249178 0.77 CCR3 (0.42) MEN1KMT2APOLB
SCHEMBL13945358 0.76 AR (0.40) MAPTMEN1KMT2ATP53ALDH1A1
SCHEMBL8093682 0.76 SCN5A (0.40) MAPTMEN1KMT2ATP53ALDH1A1

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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
WO-2009000085-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES USEFUL AS MODULATORS OF GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2008-12-31 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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS TRPV1, TRPV2, TRPA1 LMNA 2848/4885MAPT 2142/4885MEN1 4478/4885

“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.