SCHEMBL9667334

SCHEMBL9667334

CCC(N1CCc2cc(OC)c(OC)cc2C(=O)C1=O)N(C)C(C)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ GPR84 Q9NQS5 6/20 0.36
▸ PDE4A P27815 4/20 0.36
▸ ATM Q13315 1/20 0.36
▸ KDM4E B2RXH2 5/20 0.36
▸ ALDH1A1 P00352 5/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ BCHE P06276 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ HPGD P15428 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
Hydrochloric Acid SCHEMBL9668438 0.99 GPR84 (0.36) MEN1KMT2AGPR84PDE4AATM
SCHEMBL9667382 0.95 MEN1 (0.40) MEN1KMT2AGPR84PDE4AATM
SCHEMBL9667498 0.86 GAA (0.40) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL9668308 0.86 MEN1 (0.40) MEN1KMT2AGPR84PDE4AATM
Hydrochloric Acid SCHEMBL9667430 0.85 GAA (0.39) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL9667669 0.83 HSD11B1 (0.36) —
SCHEMBL10521009 0.83 KDM4E (0.39) KMT2AKDM4EALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL10519607 0.82 KDM4E (0.39) KMT2AKDM4EALDH1A1TSHRHSD17B10
SCHEMBL10518805 0.82 DRD1 (0.39) KDM4EALDH1A1TSHRHSD17B10KRAS
SCHEMBL10694975 0.82 MTNR1B (0.39) PDE4AALDH1A1HTTRAB9A

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
EP-0259793-B1 NAPHTHYL DERIVATIVES, MEDICAMENTS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION Dr. Karl Thomae GmbH (DE) 1992-07-01 — — EP disclosed
EP-0347066-A1 New enantiomers and their isolation H. LUNDBECK A/S (DK) 1989-12-20 — — EP disclosed
US-4871735-A HYPOTENSIVE, ANTIISCHEMIC AGENTS DR. KARL THOMAE GMBH 1989-10-03 — — US disclosed
EP-0259793-A1 Naphthyl derivatives, medicaments containing them and processes for their preparation Dr. Karl Thomae GmbH (DE) 1988-03-16 — — EP disclosed
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