SCHEMBL9813822

SCHEMBL9813822

CN(C)c1ccccc1C(C)(C)CC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.39
MAPT P10636 3/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 2/20 0.35
TSHR P16473 2/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SHBG P04278 1/20 0.35
KDM4E B2RXH2 1/20 0.34
CHEK1 O14757 1/20 0.34
NEK2 P51955 1/20 0.34
LIMK1 P53667 1/20 0.34
DYRK1A Q13627 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
CA2 P00918 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 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
SCHEMBL20968828 0.78 ESR1 (0.35) HTR6MAPTALDH1A1GAATSHR
SCHEMBL9813825 0.78 CNR2 (0.38) HTR6GAA
SCHEMBL19388473 0.77 CNR2 (0.40)
SCHEMBL29987688 0.76 ALDH1A1 (0.46) HTR6MAPTALDH1A1GAATSHR
SCHEMBL1201242 0.76 ALDH1A1 (0.46) HTR6MAPTALDH1A1GAATSHR
SCHEMBL3450294 0.75 ESR1 (0.31) SMN1; SMN2SHBGCYP2C19
Hydrochloric Acid SCHEMBL2870378 0.74 ALDH1A1 (0.44) HTR6MAPTALDH1A1GAATSHR
SCHEMBL18517194 0.72 MAPT (0.43) HTR6MAPTALDH1A1GAATSHR
SCHEMBL28210960 0.71 RELA (0.33)
SCHEMBL324566 0.71 ALDH1A1 (0.58) MAPTALDH1A1TSHRTP53SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326975-B1 LUBRICANT FOR TRACTION DRIVE WITH CONTINUOUSLY VARIABLE TRANSMISSION Mineralölwerke Wenzel und Weidmann Zweigniederlassung der Fuchs Mineralölwerke GmbH, Mannheim (DE) 1991-07-31 EP disclosed
EP-0326975-A1 Lubricant for traction drive with continuously variable transmission Mineralölwerke Wenzel und Weidmann Zweigniederlassung der Fuchs Mineralölwerke GmbH, Mannheim (DE) 1989-08-09 EP disclosed
US-4279761-A LUBRICANT ADDITIVE CIBA-GEIGY CORPORATION (US) 1981-07-21 US disclosed
US-4244827-A AS STABILIZING ADDITIVES FOR LUBRICANTS CIBA-GEIGY CORPORATION (US) 1981-01-13 US disclosed
US-4080307-A AMMONIUM SALTS OF 1,3-OXA- OR 1,3-THIA-PHOSPHETANES CIBA-GEIGY AG (CH) 1978-03-21 US disclosed