SCHEMBL11167746

SCHEMBL11167746

CCOC(=O)Nc1ccc(OCCCN2CCN(c3ccccc3)CC2)c(OC)c1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.55
▸ QPCT Q16769 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ MCHR1 Q99705 5/20 0.53
▸ TP53 P04637 2/20 0.52
▸ DRD2 P14416 2/20 0.51
▸ ADRA1A P35348 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ BCHE P06276 2/20 0.50
▸ ACHE P22303 2/20 0.50
▸ HTR1A P08908 2/20 0.50
▸ HTR4 Q13639 1/20 0.50
▸ GFER P55789 1/20 0.49

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
SCHEMBL11171069 0.96 QPCT (0.52) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11184745 0.92 DRD2 (0.51) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11166971 0.91 L3MBTL1 (0.54) MAPTUSP2ALDH1A1LMNASMN1; SMN2
SCHEMBL11163271 0.90 HTR1A (0.52) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11165829 0.88 DRD2 (0.62) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11157326 0.88 ALDH1A1 (0.54) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11173613 0.87 MCHR1 (0.66) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11198528 0.87 ALDH1A1 (0.60) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11176687 0.87 MCHR1 (0.60) MAPTQPCTUSP2ALDH1A1LMNA
SCHEMBL11169593 0.86 MAPT (0.57) MAPTQPCTUSP2ALDH1A1LMNA

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
US-4413006-A N-Aryl-N-phenoxy-alkyl-piperazine compounds useful in decreasing intracranial pressure TANABE SEIYAKU CO., LTD. (JP) 1983-11-01 — — US disclosed
EP-0034284-B1 PIPERAZINE DERIVATIVE, PROCESSES FOR PREPARING THE SAME AND THERAPEUTIC COMPOSITIONS CONTAINING IT Tanabe Seiyaku Co., Ltd. (JP) 1983-10-05 — — EP disclosed
US-4406897-A 6-Aryl-4-hydrazinyl-s-triazin-2-ones WILLIAM H. RORER, INC. (US) 1983-09-27 — — US disclosed
EP-0034284-A2 Piperazine derivative, processes for preparing the same and therapeutic compositions containing it Tanabe Seiyaku Co., Ltd. (JP) 1981-08-26 — — EP disclosed
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