SCHEMBL4496490

SCHEMBL4496490

COC(=O)c1ccc2[nH]c(NC(CCCc3ccccc3)C3CCNCC3)nc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.41
EHMT2 Q96KQ7 1/20 0.40
NPC1 O15118 5/20 0.39
RAB9A P51151 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
LMNA P02545 2/20 0.39
RECQL P46063 1/20 0.39
ABL1 P00519 1/20 0.37
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
GAA P10253 1/20 0.36
LNPEP Q9UIQ6 2/20 0.35
ERAP2 Q6P179 1/20 0.35
RAF1 P04049 1/20 0.35

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
SCHEMBL4503597 0.91 HDAC6 (0.43) HDAC6EHMT2NPC1RAB9AABL1
SCHEMBL4509585 0.81 SMN1; SMN2 (0.37) NPC1RAB9ASMN1; SMN2LMNARECQL
SCHEMBL4514352 0.80 GAA (0.45) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL4496486 0.73 GRIN2B (0.48) HDAC6EHMT2HTR1A
SCHEMBL4497491 0.72 AKR1C3 (0.38) ABL1MEN1MAPTKMT2A
SCHEMBL4505054 0.71 SMYD3 (0.37) NPC1RAB9ASMN1; SMN2ABL1MEN1
SCHEMBL4496639 0.70 SMYD3 (0.39) NPC1RAB9ASMN1; SMN2LMNAMEN1
SCHEMBL4502218 0.69 MEN1 (0.38) NPC1RAB9AMEN1KMT2AMMP2
SCHEMBL27526929 0.69 NPY5R (0.50) NPC1RAB9ASMN1; SMN2LMNAMEN1
SCHEMBL5391813 0.69 RAF1 (0.62) NPC1RAB9ASMN1; SMN2LMNARECQL

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 HDAC6 198/4885EHMT2 3043/4885NPC1 411/4885

“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.