SCHEMBL13600348

SCHEMBL13600348

CB(O)Nc1cc(CN2CCN(C(=O)c3ccc(Br)cc3)CC2)ccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR183 P32249 1/20 0.53
▸ THRB P10828 1/20 0.50
▸ KMT2A Q03164 2/20 0.47
▸ PRKAA2 P54646 1/20 0.46
▸ POLB P06746 2/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ TBK1 Q9UHD2 1/20 0.44
▸ ABL1 P00519 1/20 0.43
▸ BCR P11274 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ FAAH O00519 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ DUSP3 P51452 1/20 0.42
▸ PTPN5 P54829 1/20 0.42
▸ PTPN11 Q06124 1/20 0.42
▸ LSS P48449 1/20 0.42
▸ PKM P14618 1/20 0.42

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
SCHEMBL12893522 0.83 KDR (0.46) TBK1FAAHKDR
SCHEMBL13607275 0.81 GPR183 (0.49) GPR183THRBKMT2APRKAA2TBK1
SCHEMBL13600351 0.79 GPR183 (0.60) GPR183THRBKMT2APRKAA2ALDH1A1
SCHEMBL13600242 0.77 TBK1 (0.43) KMT2APOLBALDH1A1KDM4ETBK1
SCHEMBL13003255 0.75 ACKR3 (0.46) KDR
SCHEMBL13319465 0.75 ACKR3 (0.46) TBK1KDR
SCHEMBL12409942 0.73 KDR (0.42) TBK1KDR
SCHEMBL13003995 0.73 KDR (0.36) ALDH1A1KDR
SCHEMBL4770714 0.73 POLB (0.57) GPR183KMT2APOLBALDH1A1KDM4E
SCHEMBL12409965 0.72 KDR (0.36) TBK1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7638531-B2 Phenoxypiperidines and analogs thereof useful as histamine H3 antagonists SCHERING CORPORATION (US) 2009-12-29 — — US disclosed
US-20070167435-A1 Phenoxypiperidines and analogs thereof useful as histamine H3 antagonists SCHERING CORPORATION 2007-07-19 — — 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-20070167435-A1 Phenoxypiperidines and analogs thereof useful as histamine H3 antagonists HRH4, HRH3, HRH2 GPR183 1240/4885THRB 643/4885KMT2A 1324/4885

“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.

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