SCHEMBL6807533

SCHEMBL6807533

CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCCN3CCN(Cc4ccccc4)CC3)cc2CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.53
ACKR3 P25106 2/20 0.52
LMNA P02545 3/20 0.49
MCHR1 Q99705 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MCHR2 Q969V1 1/20 0.49
SUCNR1 Q9BXA5 1/20 0.47
DRD4 P21917 1/20 0.47
CCR3 P51677 1/20 0.47
TP53 P04637 2/20 0.46
MAPT P10636 2/20 0.46
CACNA1G O43497 1/20 0.46
HPGD P15428 1/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46

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
Hydrochloric Acid SCHEMBL7087753 0.94 MAPK14 (0.49) MAPK14ACKR3LMNAMCHR1SMN1; SMN2
SCHEMBL5577910 0.86 MCHR2 (0.53) LMNAMCHR1SMN1; SMN2MCHR2DRD4
SCHEMBL1789738 0.85 SMN1; SMN2 (0.55) MAPK14LMNASMN1; SMN2TP53MAPT
Hydrochloric Acid SCHEMBL5578415 0.80 ACHE (0.57) LMNAMCHR1SMN1; SMN2MCHR2DRD4
Butane SCHEMBL7089633 0.79 DRD4 (0.46) LMNAMCHR1SMN1; SMN2MCHR2DRD4
SCHEMBL7089635 0.79 DRD4 (0.46) LMNAMCHR1SMN1; SMN2MCHR2DRD4
SCHEMBL1789927 0.78 DRD2 (0.57) DRD4KDM4EPKM
SCHEMBL4768858 0.76 ESR2 (0.53) MAPK14LMNASMN1; SMN2MAPTKDM4E
SCHEMBL2862442 0.76 ALDH1A1 (0.60) LMNASMN1; SMN2TP53MAPTKDM4E
SCHEMBL31301273 0.76 DRD2 (0.64) SUCNR1

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-20040063699-A1 Gpr14 antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
EP-1310490-A1 GPR14 ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2003-05-14 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-20040063699-A1 Gpr14 antagonist GPR142, GPR139, GPR4 MAPK14 256/4885ACKR3 131/4885LMNA 4037/4885

“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.