SCHEMBL5843201

SCHEMBL5843201

COC(=O)C(C)=C(C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
EGLN1 Q9GZT9 1/20 0.37
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
MAPT P10636 1/20 0.32
TGFBR1 P36897 1/20 0.32
TET2 Q6N021 1/20 0.32
HCAR2 Q8TDS4 2/20 0.31
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
TSHR P16473 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
SCHEMBL5843191 1.00 ALDH1A1 (0.46) ALDH1A1EGLN1MGAMGAASI
SCHEMBL7771273 1.00 ALDH1A1 (0.46) ALDH1A1EGLN1MGAMGAASI
Potassium SCHEMBL8957353 0.97 ALDH1A1 (0.43) ALDH1A1EGLN1MGAMGAASI
SCHEMBL8957349 0.97 ALDH1A1 (0.43) ALDH1A1EGLN1MGAMGAASI
SCHEMBL305582 0.87 ALDH1A1 (0.56) ALDH1A1EGLN1MGAMGAASI
SCHEMBL305583 0.87 ALDH1A1 (0.56) ALDH1A1EGLN1MGAMGAASI
SCHEMBL11147178 0.87 ALDH1A1 (0.56) ALDH1A1EGLN1MGAMGAASI
Ammonia Solution, Strong SCHEMBL6537012 0.84 ALDH1A1 (0.53) ALDH1A1EGLN1MGAMGAASI
Ammonia Solution, Strong SCHEMBL7633955 0.84 ALDH1A1 (0.53) ALDH1A1EGLN1MGAMGAASI
SCHEMBL15962407 0.79

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
US-7101630-B2 Diarylamino group-containing copolymer, organic electroluminescent device, and method of producing hole transport layer for organic electroluminescent device KAWAMURA INSTITUTE OF CHEMICAL RESEARCH (JP) 2006-09-05 US disclosed
US-20050008893-A1 Diarylamino group-containing copolymer, organic electroluminescent device, and method of producing hole transport layer for organic electroluminescent device KAWAMURA INSTITUTE OF CHEMICAL RESEARCH (JP) 2005-01-13 US disclosed
EP-0711813-B1 Antifouling coating composition HITACHI CHEMICAL CO LTD (JP) 2001-07-25 EP disclosed
US-5773508-A BIODEGRADABLE POLYMER OF ADDITION COPOLYMERS FOR PROTECTIVE COATINGS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-06-30 US disclosed
EP-0711813-A2 Coating varnish composition and antifouling coating composition Hitachi Chemical Co., Ltd. (JP) 1996-05-15 EP disclosed
EP-0093924-B1 PHOTOGRAPHIC REGISTRATION MATERIAL Agfa-Gevaert AG (DE) 1987-05-27 EP disclosed