SCHEMBL3048725

SCHEMBL3048725

O=C1CC(c2ccccc2)CCN1CO

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.54
WDR77 Q9BQA1 2/20 0.54
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53
CHRM2 P08172 2/20 0.51
CHRM4 P08173 2/20 0.51
CHRM5 P08912 2/20 0.51
CHRM1 P11229 2/20 0.51
CHRM3 P20309 2/20 0.51
SLC18A3 Q16572 2/20 0.49
TP53 P04637 1/20 0.48
BRD4 O60885 3/20 0.46
ALDH1A1 P00352 3/20 0.44
SIGMAR1 Q99720 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL3038179 0.84 HPGD (0.56) PRMT5WDR77HPGDTSHRCHRM2
SCHEMBL11123316 0.84 HPGD (0.53) PRMT5WDR77HPGDTSHRCHRM2
SCHEMBL2958047 0.83 TSHR (0.69) HPGDTSHRCHRM2CHRM4CHRM5
SCHEMBL13622588 0.80 PRMT5 (0.57) PRMT5WDR77HPGDTSHRCHRM2
SCHEMBL16059034 0.79 PRMT5 (0.47) PRMT5WDR77HPGDTSHRCHRM2
SCHEMBL21821578 0.76 BRD4 (0.51) HPGDTSHRTP53BRD4ALDH1A1
SCHEMBL12719792 0.75 BRD4 (0.69) HPGDTSHRSLC18A3BRD4SIGMAR1
SCHEMBL3059062 0.74 SRD5A1 (0.59) HPGDTSHRCHRM2CHRM4CHRM5
SCHEMBL2328981 0.74 PRMT5 (0.43) PRMT5WDR77HPGDTSHRCHRM2
SCHEMBL7812899 0.74 HPGD (0.59) HPGDTSHRCHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222326-A1 New Heterocyclic Derivatives Useful For The Treatment of CNS Disorders UCB PHARMA, S.A. (BE) 2010-09-02 US claimed
EP-2152262-A2 NEW HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS UCB Pharma, S.A. (BE) 2010-02-17 EP claimed
WO-2008132139-A2 NEW HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS UCB PHARMA S.A. (BE) 2008-11-06 WO claimed
WO-2008132142-A2 NEW HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS UCB PHARMA S.A. (BE) 2008-11-06 WO claimed
US-20100222326-A1 New Heterocyclic Derivatives Useful For The Treatment of CNS Disorders UCB PHARMA, S.A. (BE) 2010-09-02 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-20100222326-A1 New Heterocyclic Derivatives Useful For The Treatment of CNS Disorders CNR2, CNR1, SLC18A2 PRMT5 2288/4885WDR77 4418/4885HPGD 472/4885

“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.