SCHEMBL27300413

SCHEMBL27300413

NN1CCC[C@@H](Cc2ccccc2)[C@@H]1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40
▸ SLC18A3 Q16572 3/20 0.39
▸ PRMT3 O60678 1/20 0.39
▸ CARM1 Q86X55 1/20 0.39
▸ PRMT6 Q96LA8 1/20 0.39
▸ PRMT1 Q99873 1/20 0.39
▸ PRMT8 Q9NR22 1/20 0.39
▸ HSD11B1 P28845 1/20 0.38
▸ CCR3 P51677 1/20 0.38

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
SCHEMBL27295072 1.00 CYP2C9 (0.41) CYP2C9CYP2C19LMNACYP1A2RECQL
SCHEMBL27295071 1.00 CYP2C9 (0.41) CYP2C9CYP2C19LMNACYP1A2RECQL
SCHEMBL4918201 0.84 DRD4 (0.41) CARM1PRMT6
SCHEMBL27389644 0.84 DRD4 (0.41) CARM1PRMT6
Hydrochloric Acid SCHEMBL4917162 0.83 DRD4 (0.41) CARM1PRMT6
SCHEMBL27365754 0.78 TACR1 (0.53) SMN1; SMN2
Hydrochloric Acid SCHEMBL7837990 0.77 TACR1 (0.52) SMN1; SMN2
SCHEMBL7824569 0.76 NR3C1 (0.38) —
SCHEMBL7824564 0.76 NR3C1 (0.38) —
SCHEMBL7824572 0.76 NR3C1 (0.38) —

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1045595-C Process for the preparation of the intermediates used in the synthesis of 3-aminopiperidine derivatives PFIZER (US) 1999-10-13 — — CN disclosed
CN-1035944-C 3-aminopiperidine derivatives and related nitrogen-containing heterocyclic compounds PFIZER (US) 1997-09-24 — — CN disclosed
CN-1087083-A The intermediates preparation of synthetic 3-amino piperidine derivatives PFIZER (US) 1994-05-25 — — CN disclosed
CN-1053060-A 3-aminopiperidine derivatives and related nitrogen-containing heterocycles PFIZER (US) 1991-07-17 — — CN disclosed
Send feedback