SCHEMBL3993905

SCHEMBL3993905

CC(C)(C)C(O)(C(=O)O)C(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ HMGCR P04035 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ TBXA2R P21731 1/20 0.38
▸ ADRA1A P35348 1/20 0.38
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ TET2 Q6N021 1/20 0.35
▸ TP53 P04637 1/20 0.33
▸ FFAR3 O14843 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ FYN P06241 1/20 0.31

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
SCHEMBL1195464 0.93 TSHR (0.56) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL27667108 0.76 TSHR (0.53) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL29373 0.72 — —
SCHEMBL1618313 0.72 ALDH1A1 (1.00) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL38460 0.72 — —
SCHEMBL5464430 0.71 ALDH1A1 (0.56) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL1953736 0.71 TSHR (0.56) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL10949463 0.71 TSHR (0.56) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL1953738 0.71 TSHR (0.56) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL2102481 0.71 TSHR (0.56) TSHRALDH1A1HMGCRCHRM1TBXA2R

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
US-7550254-B2 Fluorinated silsesquioxane polymers and use thereof in lithographic photoresist compositions INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2009-06-23 — — US disclosed
US-20070202440-A1 Fluorinated silsesquioxane polymers and use thereof in lithographic photoresist compositions INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2007-08-30 — — US disclosed
US-7261992-B2 Fluorinated silsesquioxane polymers and use thereof in lithographic photoresist compositions INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2007-08-28 — — US disclosed
US-20020090572-A1 Substantially transparent aqueous base soluble polymer system for use in 157 nm resist applications GLOBALFOUNDRIES U.S. INC. 2002-07-11 — — US disclosed
US-20020081520-A1 Substantially transparent aqueous base soluble polymer system for use in 157 nm resist applications GLOBALFOUNDRIES INC. (KY) 2002-06-27 — — US disclosed
Send feedback