SCHEMBL4250520

SCHEMBL4250520

COc1ccc(-c2ccccc2N(CC2C3CCC2CN(Cc2ccccc2)C3)C(=O)O)cc1O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
P4HB P07237 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
PAX8 Q06710 1/20 0.44
ACHE P22303 3/20 0.40
BCHE P06276 1/20 0.40
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR5 Q9H228 1/20 0.38
LMNA P02545 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
HTR7 P34969 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
SCHEMBL4242086 0.85 MEN1 (0.42) MEN1NPC1P4HBRAB9AKMT2A
SCHEMBL4238450 0.84 MEN1 (0.41) MEN1KMT2AACHEBCHESIGMAR1
SCHEMBL4248022 0.83 GRIN2B (0.40) ACHES1PR1S1PR5SIGMAR1
SCHEMBL4244909 0.81 S1PR1 (0.44) MEN1RAB9AKMT2AACHES1PR1
SCHEMBL4241455 0.81 SIGMAR1 (0.41) ACHES1PR1S1PR5SIGMAR1
SCHEMBL4244062 0.80 SIGMAR1 (0.48) NPC1RAB9AACHES1PR1S1PR5
SCHEMBL4237568 0.77 KDM4E (0.42) BCHELMNASIGMAR1
SCHEMBL4242012 0.75 ACHE (0.45) MEN1KMT2AACHES1PR1S1PR5
SCHEMBL4237497 0.74 SIGMAR1 (0.44) MEN1KMT2APAX8ACHEBCHE
SCHEMBL4249836 0.74 GRIN2B (0.40) ACHEBCHES1PR1S1PR5SIGMAR1

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-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US claimed
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 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-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 MEN1 1950/4885NPC1 1644/4885P4HB 3931/4885

“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.