SCHEMBL3205153

SCHEMBL3205153

Nc1nc(Cl)cc(C2=CCCCCC2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 10/20 0.44
HSP90AA1 P07900 9/20 0.44
KDM4E B2RXH2 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
PSMB5 P28074 3/20 0.35
PSMB1 P20618 1/20 0.35
ADCY10 Q96PN6 1/20 0.35
ATR Q13535 1/20 0.34
CDC7 O00311 1/20 0.33
DAPK3 O43293 1/20 0.33
PRKD3 O94806 1/20 0.33

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
SCHEMBL29064919 0.98 HSP90AB1 (0.45) HSP90AB1HSP90AA1KDM4ETDP1CASP3
SCHEMBL25166373 0.81 TDP1 (0.45) TDP1CASP3SENP8SENP7SENP6
SCHEMBL19531947 0.77 TDP1 (0.37) TDP1CASP3SENP8SENP7SENP6
SCHEMBL25166338 0.75 TDP1 (0.40) TDP1CASP3SENP8SENP7SENP6
SCHEMBL604723 0.72 HRH4 (0.57)
SCHEMBL605921 0.71 HRH4 (0.53) TDP1
SCHEMBL3207696 0.71 HSP90AA1 (0.41) HSP90AB1HSP90AA1KDM4EADCY10
SCHEMBL19531950 0.70 TDP1 (0.37) TDP1CASP3SENP8SENP7SENP6
SCHEMBL25729525 0.68 TDP1 (0.45) KDM4ETDP1CASP3SENP8SENP7
SCHEMBL15948014 0.67 TDP1 (0.41) TDP1CASP3SENP8SENP7SENP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100035863-A1 2 Amino-Pyrimidine Derivatives As H4 Receptor Antagonists, Processes For Preparing Them And Their Use In Pharmaceutical Compositions UCB PHARMA, S.A. (BE) 2010-02-11 US disclosed
EP-2066645-A2 2 AMINO-PYRIMIDINE DERIVATIVES AS H4 RECEPTOR ANTAGONISTS, PROCESSES FOR PREPARING THEM AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS UCB Pharma S.A. (BE) 2009-06-10 EP disclosed
WO-2008031556-A2 2 AMINO-PYRIMIDINE DERIVATIVES AS H4 RECEPTOR ANTAGONISTS, PROCESSES FOR PREPARING THEM AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS UCB PHARMA, S.A. (BE) 2008-03-20 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-20100035863-A1 2 Amino-Pyrimidine Derivatives As H4 Receptor Antagonists, Processes For Preparing Them And Their Use In Pharmaceutical Compositions HRH4, HRH2, HRH3 HSP90AB1 3838/4885HSP90AA1 4039/4885KDM4E 1873/4885

“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.