SCHEMBL5405317

SCHEMBL5405317

c1ccc2cc(C3CC3)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 10/20 0.59
DRD2 P14416 1/20 0.59
SLC6A2 P23975 8/20 0.55
SLC6A3 Q01959 8/20 0.55
CYP2D6 P10635 1/20 0.55
KCNH2 Q12809 1/20 0.55
KDM4E B2RXH2 1/20 0.52
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
KDM1A O60341 2/20 0.44
MAOB P27338 2/20 0.44
MAOA P21397 1/20 0.44

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
Methyl Alcohol SCHEMBL10694365 0.94 SLC6A4 (0.58) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL5400233 0.91 SLC6A4 (0.56) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL4648603 0.91 SLC6A4 (0.56) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL4458583 0.90 SLC6A4 (0.55) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL28706053 0.90 SLC6A4 (0.51) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
Naphthalene SCHEMBL9359039 0.89 BACE1 (0.54) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL3673985 0.89 BACE1 (0.54) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL28228539 0.89 BACE1 (0.54) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL13737351 0.88 SLC6A4 (0.54) SLC6A4DRD2SLC6A2SLC6A3CYP2D6
SCHEMBL13738724 0.88 SLC6A4 (0.54) SLC6A4DRD2SLC6A2SLC6A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118390073-A Organic electrochemical synthesis method of cyclopropane compound 南京林业大学 2024-07-26 CN disclosed
CN-117088796-A Method for synthesizing beta-trifluoromethylthioketone derivative by ring opening of cyclopropyl alcohol derivative 天津师范大学 2023-11-21 CN disclosed
CN-116730784-A Synthesis method of malonic acid derivative 华南理工大学 2023-09-12 CN disclosed
EP-3736265-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS Oryzon Genomics, S.A. (ES) 2020-11-11 EP disclosed
US-7192684-B2 Polymerizable silicon-containing compound, manufacturing method, polymer, resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-03-20 US disclosed
US-20040067436-A1 Polymerizable silicon-containing compound, manufacturing method, polymer, resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-04-08 US disclosed
US-4207241-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS AND ANTIPRURITIC AGENTS SYNTEX CORPORATION (US) 1980-06-10 US disclosed
US-4097674-A ANTIINFLAMMATORY, ANTIPYRETIC, ANTIPRURITIC AGENTS, ANALGESICS SYNTEX CORPORATION (US) 1978-06-27 US disclosed
US-4051233-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (US) 1977-09-27 US disclosed
US-4048330-A Compositions containing 2-(6'-substituted-2'-naphthyl)acetic acid esters used for treating inflammation, pain or pyrexia SYNTEX CORPORATION (US) 1977-09-13 US disclosed
US-4009197-A 2-(6-Substituted-2'-naphthyl) acetic acid derivatives and the salts and esters thereof SYNTEX CORPORATION (PM) 1977-02-22 US disclosed
US-4001301-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, ANTI-PRURITIC SYNTEX CORPORATION (PM) 1977-01-04 US disclosed
US-3998966-A Anti-inflammatory, analgesic, anti-pyretic and anti-pruritic 6-substituted 2-naphthyl acetic acid derivative-containing compositions and methods of use thereof SYNTEX CORPORATION (PM) 1976-12-21 US disclosed
US-3980699-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (PM) 1976-09-14 US disclosed
US-3978124-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 US disclosed
US-3978116-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 US disclosed