SCHEMBL7555846

SCHEMBL7555846

CC1CN(C(=O)CN2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c2ccccc21

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.77
DRD4 P21917 14/20 0.77
L3MBTL1 Q9Y468 1/20 0.49
HIF1A Q16665 1/20 0.47
EPAS1 Q99814 1/20 0.47
MEN1 O00255 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
KMT2A Q03164 1/20 0.47
FAAH O00519 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
NOTUM Q6P988 1/20 0.47

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
SCHEMBL7558681 0.88 DRD4 (0.81) DRD2DRD4MEN1ADRA1DADRA1A
SCHEMBL7553491 0.87 DRD2 (0.83) DRD2DRD4MEN1ADRA1DADRA1A
SCHEMBL7551427 0.87 DRD2 (0.83) DRD2DRD4MEN1ADRA1DADRA1A
SCHEMBL7552763 0.87 DRD4 (1.00) DRD2DRD4MEN1ADRA1DADRA1A
SCHEMBL7555293 0.84 DRD4 (0.82) DRD2DRD4MEN1ADRA1DADRA1A
SCHEMBL7555333 0.84 DRD2 (0.78) DRD2DRD4MEN1ADRA1DADRA1A
SCHEMBL8208943 0.76 DRD2 (0.65) DRD2DRD4NOTUM
SCHEMBL9052703 0.71 SIGMAR1 (0.63) DRD2DRD4L3MBTL1HIF1AEPAS1
SCHEMBL7550236 0.71 NOTUM (0.69) DRD2DRD4MEN1KMT2ANOTUM
SCHEMBL14438076 0.69 L3MBTL1 (0.74) L3MBTL1HIF1AEPAS1FAAHSIGMAR1

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-20020128274-A1 Benzylpiperazinyl-indolinylethanones NEUROGEN CORPORATION. 2002-09-12 US disclosed
US-6355644-B1 NERVOUS SYSTEM DISORDERS AND TREATMENT OF SCHIZOPHRENIA AND BIPOLAR DISORDER NEUROGEN CORPORATION 2002-03-12 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-20020128274-A1 Benzylpiperazinyl-indolinylethanones GABRP, GABBR1, GABARAP DRD2 30/4885DRD4 57/4885L3MBTL1 3408/4885

“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.