SCHEMBL3264705

SCHEMBL3264705

CC(C)(C)OC(=O)N1CCc2c(O)nc(N)nc2C1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.49
PARP1 P09874 1/20 0.47
TNKS2 Q9H2K2 1/20 0.47
PARP2 Q9UGN5 1/20 0.47
NR1H2 P55055 1/20 0.46
ESR2 Q92731 1/20 0.44
MAPT P10636 3/20 0.43
KDM4E B2RXH2 1/20 0.43
F12 P00748 3/20 0.42
MTOR P42345 1/20 0.40
SMARCA2 P51531 1/20 0.37
SMARCA4 P51532 1/20 0.37
PBRM1 Q86U86 1/20 0.37
P2RX3 P56373 2/20 0.37
C5AR1 P21730 1/20 0.37
PRKCI P41743 1/20 0.36
GRAMD1A Q96CP6 1/20 0.36

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
SCHEMBL13246138 0.90 ADORA1 (0.46) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL30776241 0.86 PARP1 (0.47) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL13250465 0.86 PARP1 (0.47) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL29330189 0.84 PARP1 (0.46) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL16034353 0.82 PARP1 (0.45) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL19616687 0.82 PARP1 (0.45) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL9951661 0.82 PARP1 (0.45) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL22720588 0.81 PARP1 (0.47) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL29329889 0.81 PARP1 (0.44) ADORA1PARP1TNKS2PARP2NR1H2
SCHEMBL3233619 0.80 PARP1 (0.43) ADORA1PARP1TNKS2PARP2NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298289-A1 HETEROBICYCLIC COMPOUNDS AS HISTAMINE H4-RECEPTOR ANTAGONISTS UCB PHARMA, S.A. (BE) 2010-11-25 US claimed
US-20100298289-A1 HETEROBICYCLIC COMPOUNDS AS HISTAMINE H4-RECEPTOR ANTAGONISTS UCB PHARMA, S.A. (BE) 2010-11-25 US disclosed
EP-2209775-A1 HETEROBICYCLIC COMPOUNDS AS HISTAMINE H4-RECEPTOR ANTAGONISTS UCB Pharma, S.A. (BE) 2010-07-28 EP disclosed
WO-2009047255-A1 HETEROBICYCLIC COMPOUNDS AS HISTAMINE H4-RECEPTOR ANTAGONISTS UCB PHARMA, S.A. (BE) 2009-04-16 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-20100298289-A1 HETEROBICYCLIC COMPOUNDS AS HISTAMINE H4-RECEPTOR ANTAGONISTS HRH4, HRH2, HRH3 ADORA1 73/4885PARP1 2365/4885TNKS2 3122/4885

“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.