SCHEMBL7102055

SCHEMBL7102055

CC1C[C](c2ccc(O)cc2)CC(C)(C)C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 4/20 0.46
ESR1 P03372 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 7/20 0.34
NPSR1 Q6W5P4 2/20 0.34
ALOX12 P18054 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 3/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 2/20 0.31
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL1858458 0.83 PTGS1 (0.37) ALDH1A1NPSR1ALOX12KMT2AKDM4E
Phenol SCHEMBL15518162 0.70 ESR1 (0.41) ESR2ESR1ALDH1A1NPSR1ALOX12
Phenol SCHEMBL21963466 0.70 ESR1 (0.41) ESR2ESR1ALDH1A1NPSR1ALOX12
Phenol SCHEMBL7159260 0.70 ESR1 (0.41) ESR2ESR1ALDH1A1NPSR1ALOX12
SCHEMBL10940394 0.69 ALDH1A1 (0.39) ESR2ESR1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL335898 0.63 ESR2 (0.52) ESR2ESR1ALDH1A1LMNA
SCHEMBL21291805 0.63 ESR2 (1.00) ESR2ESR1ALDH1A1ALOX12KDM4E
SCHEMBL18187 0.63 ESR2 (1.00) ESR2ESR1ALDH1A1ALOX12KDM4E
SCHEMBL4826617 0.63 ESR2 (1.00) ESR2ESR1ALDH1A1ALOX12KDM4E
SCHEMBL5918165 0.62 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1NPSR1ALOX12KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3555168-A1 EPOXY RESIN ADHESIVE WITH HIGH COMPRESSIVE STRENGTH Sika Technology AG (CH) 2019-10-23 EP disclosed
CN-1989206-A Cyclic oligoformals in polycarbonates BAYER MATERIALSCIENCE AG (DE) 2007-06-27 CN disclosed
EP-1352012-A1 PIGMENT PREPARATIONS BASF AKTIENGESELLSCHAFT (DE) 2003-10-15 EP disclosed
EP-1340286-A2 REPLACABLE ANTENNA ARRANGEMENT INTEGRATED WITHIN THE BODYWORK PART OF A VEHICLE DaimlerChrysler AG (DE) 2003-09-03 EP disclosed
WO-2002047198-A2 REPLACABLE ANTENNA ARRANGEMENT INTEGRATED WITHIN THE BODYWORK PART OF A VEHICLE DAIMLERCHRYSLER AG (DE) 2002-06-13 WO disclosed
WO-2002040575-A1 PIGMENT PREPARATIONS BASF AKTIENGESELLSCHAFT (DE) 2002-05-23 WO disclosed