SCHEMBL7587503

SCHEMBL7587503

OC1CCC(c2ccccc2)(c2ccccc2)C1O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.46
ADRA1D P25100 2/20 0.41
ADRA1B P35368 2/20 0.41
SLC18A3 Q16572 1/20 0.41
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
ALOX5AP P20292 1/20 0.38
GAA P10253 1/20 0.38
ADRA1A P35348 1/20 0.36
AKR1C1 Q04828 1/20 0.36

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
SCHEMBL170243 0.88 SLC18A3 (0.45) HTR1ASLC18A3LMNAHTT
SCHEMBL1958572 0.84 SLC18A3 (0.47) HTR1ASLC18A3AKR1C1
SCHEMBL1958981 0.84 SLC18A3 (0.47) HTR1ASLC18A3AKR1C1
SCHEMBL1955880 0.84 SLC18A3 (0.47) HTR1ASLC18A3AKR1C1
SCHEMBL1954906 0.84 SLC18A3 (0.47) HTR1ASLC18A3AKR1C1
SCHEMBL12276561 0.84 SLC18A3 (0.47) HTR1ASLC18A3AKR1C1
SCHEMBL1958752 0.84 SLC18A3 (0.47) HTR1ASLC18A3AKR1C1
SCHEMBL22436648 0.80 HTR1A (0.44) HTR1AADRA1DADRA1BALOX5AP
SCHEMBL15760879 0.75 KDM1A (0.46)
SCHEMBL17018535 0.75 KDM1A (0.46)

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-0915921-B1 CROSS-LINKING AGENTS FOR EMULSION POLYMERS BASF AG (DE) 2002-10-02 EP disclosed
EP-0915920-B1 IMPACT RESISTANT THERMOPLASTIC MOULDING MATERIALS BASF AG (DE) 2001-09-19 EP disclosed
US-6197872-B1 CORE-SHELL EMULSION POLYMER BASF AKTIENGESELLSCHAFT (DE) 2001-03-06 US disclosed
US-6103821-A POLYMERIZING A CROSS-LINKED PARTICULATE EMULSION POLYMER IN PRESENCE OF A CURING AGENT CONSISTING OF A HOMO- OR CO-ADDITION POLYMER BASF AKTIENGESELLSCHAFT (DE) 2000-08-15 US disclosed