SCHEMBL3473343

SCHEMBL3473343

C=Cc1ccccc1C(C)(C)N

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP2C19 P33261 1/20 0.32
ALOX12 P18054 1/20 0.32
SLC6A2 P23975 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
SLC9A1 P19634 1/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 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
Hydrochloric Acid SCHEMBL9567693 0.98 ALDH1A1 (0.40) ALDH1A1TSHRTDP1CYP2C19ALOX12
SCHEMBL27805 0.82 ALDH1A1 (0.50) ALDH1A1TSHRTDP1ALOX12
SCHEMBL29801228 0.82 ALDH1A1 (0.50) ALDH1A1TSHRTDP1ALOX12
Hydrochloric Acid SCHEMBL985239 0.80 ALDH1A1 (0.32) ALDH1A1TDP1ALOX12SLC9A1
Bromide SCHEMBL987667 0.80 ALDH1A1 (0.32) ALDH1A1TDP1ALOX12SLC9A1
Benzene SCHEMBL11667348 0.80 ALDH1A1 (0.48) ALDH1A1TSHRTDP1ALOX12
SCHEMBL7141124 0.80 ALDH1A1 (0.43) ALDH1A1TSHRTDP1ALOX12
SCHEMBL8647604 0.78 ALDH1A1 (0.41) ALDH1A1TSHRTDP1ALOX12GRIN2D
SCHEMBL2948538 0.78 ALDH1A1 (0.41) ALDH1A1TSHRTDP1CYP2C19ALOX12
SCHEMBL3150347 0.78 LMNA (0.50) ALDH1A1TSHRTDP1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006110540-A2 ANTIMICROBIAL POLYMER COATINGS AND A METHOD PRODUCING THEM VIA CHEMICAL VAPOUR DEPOSITION MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-10-19 WO claimed
US-20060228966-A1 Chemical vapor deposition of antimicrobial polymer coatings MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-10-12 US claimed
US-11535006-B2 Nanocomposite surfaces with electrically switchable adhesion MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2022-12-27 US disclosed
US-20200254718-A1 NANOCOMPOSITE SURFACES WITH ELECTRICALLY SWITCHABLE ADHESION MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2020-08-13 US disclosed
US-20100303877-A1 Controlled Release Hydrogel Films BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-12-02 US disclosed
US-7563734-B2 Chemical vapor deposition of antimicrobial polymer coatings MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-07-21 US disclosed
WO-2006110540-A2 ANTIMICROBIAL POLYMER COATINGS AND A METHOD PRODUCING THEM VIA CHEMICAL VAPOUR DEPOSITION MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-10-19 WO disclosed
US-20060228966-A1 Chemical vapor deposition of antimicrobial polymer coatings MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-10-12 US disclosed
US-5015551-A Resin particles dispersed in a dielectric nonaqueous solvent for making printing plates or sheets FUJI PHOTO FILM CO., LTD. (JP) 1991-05-14 US disclosed