SCHEMBL11157326

SCHEMBL11157326

COc1cc(NC(=O)OC(C)(C)C)ccc1OCCCN1CCN(c2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.54
▸ USP2 O75604 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ DRD2 P14416 6/20 0.52
▸ MCHR1 Q99705 5/20 0.52
▸ QPCT Q16769 1/20 0.52
▸ TP53 P04637 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ HTR1A P08908 2/20 0.49
▸ BCHE P06276 2/20 0.49
▸ ACHE P22303 2/20 0.49
▸ HTR1D P28221 1/20 0.49
▸ HTR1B P28222 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
SCHEMBL11172284 0.89 ALDH1A1 (0.55) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11167746 0.88 MAPT (0.55) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11165829 0.88 DRD2 (0.62) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11198528 0.87 ALDH1A1 (0.60) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11173613 0.87 MCHR1 (0.66) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11168230 0.86 MAPT (0.55) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11176687 0.86 MCHR1 (0.60) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11160725 0.85 ALDH1A1 (0.55) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11171069 0.85 QPCT (0.52) ALDH1A1USP2LMNAMAPTHPGD
SCHEMBL11169527 0.85 DRD2 (0.58) ALDH1A1USP2LMNAMAPTHPGD

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 6 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 claimed
EP-0034284-B1 PIPERAZINE DERIVATIVE, PROCESSES FOR PREPARING THE SAME AND THERAPEUTIC COMPOSITIONS CONTAINING IT Tanabe Seiyaku Co., Ltd. (JP) 1983-10-05 — — EP claimed
EP-0034284-A2 Piperazine derivative, processes for preparing the same and therapeutic compositions containing it Tanabe Seiyaku Co., Ltd. (JP) 1981-08-26 — — EP claimed
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
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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