SCHEMBL5001815

SCHEMBL5001815

Cn1c(C(=O)Nc2ccc(Cl)cc2)cc2c(O)cccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.61
NPC1 O15118 4/20 0.56
MAPT P10636 2/20 0.56
MEN1 O00255 1/20 0.56
GAA P10253 1/20 0.56
KMT2A Q03164 1/20 0.56
KDM4E B2RXH2 3/20 0.50
KDM1A O60341 1/20 0.48
RCOR1 Q9UKL0 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
RAB9A P51151 1/20 0.48
TP53 P04637 1/20 0.46
PLA2G7 Q13093 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 2/20 0.46
ROCK1 Q13464 1/20 0.46
F10 P00742 1/20 0.46

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
SCHEMBL4998178 0.81 RXFP1 (0.67) RXFP1MEN1KMT2ATP53ALDH1A1
SCHEMBL5002038 0.80 RXFP1 (0.51) RXFP1NPC1MAPTMEN1KMT2A
SCHEMBL2326927 0.74 MCL1 (0.57) RXFP1MAPTGAAKDM4ESMN1; SMN2
SCHEMBL5005344 0.73 SLC9A1 (0.51) MAPTKDM4EKDM1ARCOR1SMN1; SMN2
SCHEMBL5008054 0.73 KDM4E (0.47) RXFP1MAPTMEN1KMT2AKDM4E
SCHEMBL11608138 0.71 RXFP1 (0.60) RXFP1NPC1MAPTMEN1GAA
SCHEMBL10963185 0.71 MEN1 (0.71) NPC1MAPTMEN1GAAKMT2A
SCHEMBL10428048 0.71 P2RX1 (0.57) NPC1MAPTMEN1GAAKMT2A
SCHEMBL5981594 0.70 MAPT (0.58) RXFP1NPC1MAPTMEN1KMT2A
SCHEMBL19332243 0.70 PHGDH (0.69) RXFP1MAPTTP53THRBEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7064143-B1 Positive modulators of nicotinic receptor agonists ASTRAZENECA AB (SE) 2006-06-20 US claimed
EP-1230218-A1 POSITIVE MODULATORS OF NICOTINIC RECEPTOR AGONISTS AstraZeneca AB (SE) 2002-08-14 EP claimed
WO-2001032622-A1 POSITIVE MODULATORS OF NICOTINIC RECEPTOR AGONISTS ASTRAZENECA AB (SE) 2001-05-10 WO claimed
US-7402604-B2 Positive modulators of nicotinic receptor agonists ASTRAZENECA AB (SE) 2008-07-22 US disclosed
US-7064143-B1 Positive modulators of nicotinic receptor agonists ASTRAZENECA AB (SE) 2006-06-20 US disclosed
US-20050245595-A1 Positive modulators of nicotinic receptor agonists GURLEY DAVID 2005-11-03 US disclosed
EP-1230218-A1 POSITIVE MODULATORS OF NICOTINIC RECEPTOR AGONISTS AstraZeneca AB (SE) 2002-08-14 EP disclosed
WO-2001032622-A1 POSITIVE MODULATORS OF NICOTINIC RECEPTOR AGONISTS ASTRAZENECA AB (SE) 2001-05-10 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-20050245595-A1 Positive modulators of nicotinic receptor agonists CHRM1, CHRM2, CHRNA1 RXFP1 107/4885NPC1 1396/4885MAPT 1941/4885

“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.