SCHEMBL2958047

SCHEMBL2958047

O=C1CC(c2ccccc2)CN1CO

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.69
HPGD P15428 1/20 0.69
TP53 P04637 1/20 0.61
BRD4 O60885 4/20 0.57
CHRM2 P08172 1/20 0.57
CHRM4 P08173 1/20 0.57
CHRM5 P08912 1/20 0.57
CHRM1 P11229 1/20 0.57
CHRM3 P20309 1/20 0.57
ALDH1A1 P00352 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
LMNA P02545 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL2957434 0.83 HPGD (0.53) TSHRHPGDTP53BRD4CHRM2
SCHEMBL2954895 0.83 HPGD (0.49) TSHRHPGDTP53BRD4CHRM2
SCHEMBL9850874 0.83 TP53 (0.70) TSHRHPGDTP53BRD4CHRM2
SCHEMBL3059062 0.83 SRD5A1 (0.59) TSHRHPGDTP53BRD4CHRM2
SCHEMBL3048725 0.83 PRMT5 (0.54) TSHRHPGDTP53BRD4CHRM2
SCHEMBL11472575 0.83 TSHR (0.69) TSHRHPGDTP53BRD4CHRM2
SCHEMBL10762307 0.83 HPGD (0.69) TSHRHPGDTP53BRD4CHRM2
SCHEMBL13532862 0.83 HPGD (0.69) TSHRHPGDTP53BRD4CHRM2
SCHEMBL11471890 0.83 HPGD (0.73) TSHRHPGDTP53BRD4CHRM2
SCHEMBL2947841 0.82 HPGD (0.51) TSHRHPGDTP53CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763644-B2 Imidazole derivatives, processes for preparing them and their uses UCB PHARMA, S.A. (BE) 2010-07-27 US disclosed
EP-2050736-A1 Imidazole derivatives, processes for preparing them and their uses UCB Pharma, S.A. (BE) 2009-04-22 EP disclosed
EP-1706376-B1 IMIDAZOLE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES UCB PHARMA SA (BE) 2009-03-04 EP disclosed
US-20080081832-A1 Imidazole derivatives, processes for preparing them and their uses UCB, S.A. 2008-04-03 US disclosed
US-7244747-B2 Imidazole derivatives, processes for preparing them and their uses UCB, S.A. (BE) 2007-07-17 US disclosed
CN-1906160-A Imidazole derivatives, processes for preparing them and their uses UCB SA (BE) 2007-01-31 CN disclosed
EP-1706376-A1 IMIDAZOLE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES UCB, S.A. (BE) 2006-10-04 EP disclosed
US-20050137241-A1 Imidazole derivatives, processes for preparing them and their uses UCB PHARMA, S.A. (BE) 2005-06-23 US disclosed
WO-2005054188-A1 IMIDAZOLE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES UCB, S.A. (BE) 2005-06-16 WO disclosed
US-4216221-A MNEMIC PROCESSES U C B, SOCIETE ANONYME (BE) 1980-08-05 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 (2 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-20080081832-A1 Imidazole derivatives, processes for preparing them and their uses CYP3A4, PPIP5K2, CYP2C19 TSHR 3324/4885HPGD 79/4885TP53 2401/4885
US-20050137241-A1 Imidazole derivatives, processes for preparing them and their uses CYP3A4, PPIP5K2, CYP2C19 TSHR 3324/4885HPGD 79/4885TP53 2401/4885

“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.