SCHEMBL2954874

SCHEMBL2954874

CCCC1CC(=O)N(Cn2c(-c3ccccc3)nc3ccccc32)C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.45
HSD17B10 Q99714 3/20 0.45
ALDH1A1 P00352 4/20 0.44
PDE6D O43924 1/20 0.44
ALDH2 P05091 1/20 0.44
ALDH3A1 P30838 1/20 0.44
TP53 P04637 5/20 0.44
HPGD P15428 2/20 0.44
LMNA P02545 2/20 0.44
TSHR P16473 2/20 0.44
MAPT P10636 2/20 0.43
GAA P10253 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
POLB P06746 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
SCHEMBL2957649 0.93 MEN1 (0.43) KDM4EHSD17B10ALDH1A1TP53HPGD
SCHEMBL2957615 0.90 CYP11B2 (0.45) ALDH1A1TP53MAPTPOLB
SCHEMBL662964 0.88 ALDH1A1 (0.43) ALDH1A1TP53LMNATSHRMAPT
SCHEMBL2955770 0.85 KDM4E (0.49) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL13238348 0.85 ALDH1A1 (0.41) KDM4EHSD17B10ALDH1A1TP53TSHR
SCHEMBL661688 0.85 ALDH1A1 (0.45) KDM4EALDH1A1TP53TSHRMAPT
SCHEMBL662479 0.84 POLB (0.50) ALDH1A1TP53TSHRMAPTPOLB
SCHEMBL1665637 0.84 LMNA (0.42) KDM4EHSD17B10ALDH1A1TP53LMNA
SCHEMBL662975 0.83 LMNA (0.48) KDM4EALDH1A1HPGDLMNATSHR
SCHEMBL2954311 0.83 LMNA (0.48) HSD17B10TP53LMNAMAPTNPSR1

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-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
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
US-20050137241-A1 Imidazole derivatives, processes for preparing them and their uses UCB PHARMA, S.A. (BE) 2005-06-23 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 KDM4E 783/4885HSD17B10 3398/4885ALDH1A1 896/4885
US-20050137241-A1 Imidazole derivatives, processes for preparing them and their uses CYP3A4, PPIP5K2, CYP2C19 KDM4E 783/4885HSD17B10 3398/4885ALDH1A1 896/4885

“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.