SCHEMBL4496486

SCHEMBL4496486

COC(=O)c1ccc2[nH]c(NCC3CCN(CCCc4ccccc4)CC3)nc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 2/20 0.48
HRH1 P35367 1/20 0.47
DRD4 P21917 2/20 0.47
KDM1A O60341 4/20 0.46
EHMT2 Q96KQ7 1/20 0.45
HDAC6 Q9UBN7 3/20 0.44
KCNH2 Q12809 3/20 0.44
HDAC3 O15379 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
NCOR2 Q9Y618 1/20 0.44
CHRM4 P08173 1/20 0.44
HTR1A P08908 1/20 0.44
LTA4H P09960 1/20 0.43

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
SCHEMBL4503583 0.91 KDM1A (0.53) GRIN2BDRD4KDM1AEHMT2HDAC6
SCHEMBL4509574 0.81 HSD17B10 (0.44) DRD4HDAC6HDAC1HDAC8
SCHEMBL4514349 0.80 GRIN2B (0.56) GRIN2BKCNH2
SCHEMBL4496490 0.73 HDAC6 (0.41) EHMT2HDAC6HTR1A
SCHEMBL4497481 0.72 SMN1; SMN2 (0.44) DRD4KDM1AHDAC6MAOBHDAC1
SCHEMBL5391813 0.71 RAF1 (0.62)
SCHEMBL4504235 0.71 PTGER4 (0.49)
SCHEMBL4505044 0.71 ACHE (0.42) DRD4HDAC6HDAC1HDAC8
SCHEMBL4496634 0.70 MAPT (0.47)
SCHEMBL13991772 0.70 SMN1; SMN2 (0.56) GRIN2B

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-7517875-B2 Piperidine derivatives having CCR3 antagonism TEIJIN LIMITED (JP) 2009-04-14 US disclosed
US-20070032525-A1 Piperidine derivatives having ccr3 antagonism TEIJIN LIMITED, A JAPANESE BODY CORPORATE (JP) 2007-02-08 US disclosed
EP-1502916-A1 PIPERIDINE DERIVATIVES HAVING CCR3 ANTAGONISM TEIJIN LIMITED (JP) 2005-02-02 EP 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-20070032525-A1 Piperidine derivatives having ccr3 antagonism CCR3, CCR1, CCR4 GRIN2B 2189/4885HRH1 22/4885DRD4 759/4885

“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.