SCHEMBL998286

SCHEMBL998286

CC(Cc1ccccc1)c1ccc(Nc2ccc(C(C)Cc3ccccc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.50
▸ ESR2 Q92731 1/20 0.50
▸ SIGMAR1 Q99720 5/20 0.47
▸ TAAR1 Q96RJ0 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ ALOX15 P16050 3/20 0.47
▸ TSHR P16473 3/20 0.47
▸ ALOX12 P18054 3/20 0.47
▸ HSD17B10 Q99714 3/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ SLC18A2 Q05940 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SLC6A2 P23975 4/20 0.45

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
SCHEMBL22636537 0.96 ESR1 (0.52) ESR1ESR2SIGMAR1TAAR1ALDH1A1
SCHEMBL22636511 0.92 ESR1 (0.50) ESR1ESR2SIGMAR1TAAR1ALDH1A1
SCHEMBL998287 0.92 ESR1 (0.50) ESR1ESR2SIGMAR1TAAR1ALDH1A1
SCHEMBL1704015 0.87 NR3C2 (0.43) ESR1ESR2SIGMAR1TAAR1ALDH1A1
SCHEMBL1704016 0.87 ESR1 (0.46) ESR1ESR2SIGMAR1TAAR1ALDH1A1
SCHEMBL18715948 0.85 ALDH1A1 (0.44) ESR1ESR2SIGMAR1TAAR1ALDH1A1
SCHEMBL535702 0.83 TAAR1 (0.56) ESR1ESR2SIGMAR1TAAR1SLC18A2
SCHEMBL14799062 0.83 TAAR1 (0.56) ESR1ESR2SIGMAR1TAAR1SLC18A2
SCHEMBL8983689 0.83 TAAR1 (0.56) ESR1ESR2SIGMAR1TAAR1SLC18A2
SCHEMBL6547012 0.82 ESR1 (0.55) ESR1ESR2SIGMAR1TAAR1SLC18A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117178049-A Medium-resistant polyoxymethylene polymer compositions 国际人造丝公司 2023-12-05 — — CN disclosed
CN-116802748-A Cable with improved thermal conductivity 耐克森公司 2023-09-22 — — CN disclosed
CN-116711030-A Method for manufacturing a cable with improved thermal conductivity 耐克森公司 2023-09-05 — — CN disclosed
CN-116635474-A Cable comprising thermoplastic insulation layer with improved electrical and mechanical properties 耐克森公司 2023-08-22 — — CN disclosed
CN-111971334-B Composite of nonpolar organic polymer and ultra-low wettability carbon black 陶氏环球技术有限责任公司 2023-08-18 — — CN disclosed
CN-116601725-A Method for manufacturing a cable with improved thermal conductivity 耐克森公司 2023-08-15 — — CN disclosed
CN-111868163-B Composite of nonpolar organic polymer, polar organic polymer and ultra-low wettability carbon black 陶氏环球技术有限责任公司 2023-08-11 — — CN disclosed
CN-116583919-A Self-regulating heater 博里利斯股份公司 2023-08-11 — — CN disclosed
EP-2449016-A1 POLYMERS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS AND IODINE-CONTAINING COMPOUNDS Lanxess Deutschland GmbH (DE) 2012-05-09 — — EP disclosed
WO-2011000794-A1 POLYMERS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS AND IODINE-CONTAINING COMPOUNDS LANXESS DEUTSCHLAND GMBH (DE) 2011-01-06 — — WO disclosed
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