SCHEMBL7796544

SCHEMBL7796544

BOC(CC)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 5/20 0.40
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TAAR1 Q96RJ0 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
KIF11 P52732 1/20 0.33
TP53 P04637 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
SCHEMBL7799317 0.83 KCNN4 (0.38) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL29280866 0.81 MAPK1 (0.48) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL7764290 0.81 KCNN4 (0.43) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL6470484 0.79 LMNA (0.50) KCNN4MAPK1LMNAALDH1A1TAAR1
Hydrochloric Acid SCHEMBL27457472 0.79 LMNA (0.42) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL9194628 0.77 KCNN4 (0.40) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL22788269 0.77 KCNN4 (0.40) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL2238102 0.77 KCNN4 (0.40) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL3950657 0.77 KCNN4 (0.40) KCNN4MAPK1LMNAALDH1A1TAAR1
SCHEMBL11374241 0.76 KCNN4 (0.39) KCNN4MAPK1LMNAALDH1A1TAAR1

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-0808849-B1 Process for the production of ethylenic polymers SHOWA DENKO KK (JP) 2001-12-19 EP disclosed
US-6011127-A CATALYST COMPRISING A CHROMIUM COMPOUND, AN ALUMOXANE AND AN ORGANOMETALLIC ALKOXIDE AND/OR ORGANOMETALLIC SILOXIDE AND A CARRIER SUPPORTING THEREON THESE COMPOUNDS. SHOWA DENKO K.K. (JP) 2000-01-04 US disclosed
EP-0808849-A1 Process for the production of ethylenic polymers SHOWA DENKO KABUSHIKI KAISHA (JP) 1997-11-26 EP disclosed