SCHEMBL7168690

SCHEMBL7168690

O=C(N1CCN(c2ccc(Cl)cc2)CC1)C1(c2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.62
ALDH1A1 P00352 3/20 0.59
LMNA P02545 2/20 0.59
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
TSHR P16473 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL2471006 0.84 MAPT (0.75) ALDH1A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL2858838 0.83 MEN1 (0.75) HSD11B1ALDH1A1LMNAMEN1KMT2A
SCHEMBL3092705 0.83 AKR1C3 (0.58) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL2470194 0.81 ENPP2 (0.62) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL2471436 0.81 HSD11B1 (0.57) HSD11B1ALDH1A1LMNAMEN1KMT2A
SCHEMBL350014 0.81 HSD11B1 (0.67) HSD11B1ALDH1A1MEN1KMT2A
SCHEMBL348724 0.77 HSD11B1 (1.00) HSD11B1ALDH1A1MEN1KMT2A
SCHEMBL350767 0.77 HSD11B1 (0.70) HSD11B1ALDH1A1
SCHEMBL3129900 0.77 HSD11B1 (1.00) HSD11B1ALDH1A1LMNAMEN1KMT2A
SCHEMBL349468 0.77 HSD11B1 (1.00) HSD11B1

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-6544996-B2 A substituted or unsubstituted phenyl-(4-trans-2-phenylcyclopropyl)methylpiperazine compounds or salt useful for treating brain disorders such as schizophrenia, Parkinson, dementia, depression and anxiety NEUROGEN CORPORATION 2003-04-08 US disclosed
US-20020022630-A1 1-phenyl-4-(1-[2-aryl]cyclopropyl) methylpiperazines: dopamine receptor ligands NEUROGEN CORPORATION 2002-02-21 US disclosed
US-6284761-B1 NERVOUS SYSTEM, PSYCHOLOGICAL DISORDERS NEUROGEN CORPORATION 2001-09-04 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-20020022630-A1 1-phenyl-4-(1-[2-aryl]cyclopropyl) methylpiperazines: dopamine receptor ligands DRD2, DRD4, PARK7 HSD11B1 2349/4885ALDH1A1 391/4885LMNA 4535/4885

“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.