SCHEMBL15065200

SCHEMBL15065200

[c]1cc2ccccc2c2c1OCC=C2

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP1B1 Q16678 2/20 0.33
CYP2B6 P20813 1/20 0.33

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
SCHEMBL1041972 0.70 CA12 (0.47) CYP1A1CYP1A2CYP1B1CYP2B6
SCHEMBL87841 0.70 CA12 (0.47) CYP1A1CYP1A2CYP1B1CYP2B6
SCHEMBL29756136 0.70 CA12 (0.47) CYP1A1CYP1A2CYP1B1CYP2B6
SCHEMBL3247520 0.67 CDK2 (0.35)
Phosphoric Acid SCHEMBL31540356 0.67 CA12 (0.44) CYP1A1CYP1A2CYP1B1CYP2B6
Biphenyl SCHEMBL27372808 0.66 CYP1A2 (0.52) CYP1A1CYP1A2CYP1B1CYP2B6
Phenol SCHEMBL28029036 0.64 CYP1A2 (0.44) CYP1A1CYP1A2CYP1B1CYP2B6
Toluene SCHEMBL8134407 0.64 CYP1A2 (0.45) CYP1A1CYP1A2CYP1B1CYP2B6
SCHEMBL3094346 0.63 CYP1A2 (0.37) CYP1A1CYP1A2CYP1B1CYP2B6
SCHEMBL29809919 0.63 CYP1A2 (0.37) CYP1A1CYP1A2CYP1B1CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4003968-A1 PROCESS FOR PREPARING A COUMARIN-CAGED FORSKOLIN DERIVATIVE, FORSKOLIN DERIVATIVE AND USE OF SAID FORSKOLIN DERIVATIVE Forschungszentrum Jülich GmbH (DE) 2022-06-01 EP claimed
WO-2021013278-A1 PROCESS FOR PREPARING A COUMARIN-CAGED FORSKOLIN DERIVATIVE, FORSKOLIN DERIVATIVE AND USE OF SAID FORSKOLIN DERIVATIVE Forschungszentrum Jülich GmbH (DE) 2021-01-28 WO claimed
US-20130174289-A1 Na+/Mg2+ Exchanger FBN - LEIBNITZ-INSTITUT FUR NUTZTIERBIOLOGIE (DE) 2013-07-04 US disclosed