SCHEMBL8640855

SCHEMBL8640855

CCCCOCCc1c[c]ccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 4/20 0.38
HRH3 Q9Y5N1 2/20 0.35
KCNH2 Q12809 1/20 0.35
CYP3A4 P08684 2/20 0.34
MAPK1 P28482 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
CASP1 P29466 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLCO1B3 Q9NPD5 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
LTA4H P09960 1/20 0.33
RECQL P46063 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL10713032 0.93 ALDH1A1 (0.43) ALDH1A1HPGDTSHRHRH3CYP3A4
SCHEMBL18705909 0.84 RAB9A (0.36) MEN1KMT2ASMN1; SMN2TDP1
SCHEMBL57607 0.82 CA2 (0.40) ALDH1A1HPGDKCNH2CYP3A4MAPK1
SCHEMBL10712656 0.81 RAB9A (0.40) HRH3KCNH2MAPK1MEN1KMT2A
SCHEMBL27624397 0.81 TSHR (0.33) TSHR
SCHEMBL278144 0.80 TDP1 (0.47) ALDH1A1TSHRKCNH2CYP3A4LMNA
SCHEMBL33707 0.79 MAPK1 (0.36) ALDH1A1TSHRCYP3A4MAPK1MEN1
SCHEMBL263493 0.79 KCNH2 (0.46) ALDH1A1TSHRKCNH2CYP3A4LMNA
SCHEMBL7296736 0.79 ALDH1A1 (0.41) ALDH1A1HPGDTSHRHRH3KCNH2
SCHEMBL4865067 0.79 KCNH2 (0.46) ALDH1A1TSHRKCNH2CYP3A4LMNA

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-0510449-B1 Acid-cleavable compounds, positive-working radiation-sensitive composition containing the same and radiation-sensitive recording material prepared therefrom CLARIANT GMBH (DE) 1998-08-05 EP disclosed
US-5286602-A Acid-cleavable compounds, positive-working radiation-sensitive mixture containing these compounds, and radiation-sensitive recording material produced with this mixture HOECHST AKTIENGESELLSCHAFT (DE) 1994-02-15 US disclosed
EP-0510449-A2 Acid-cleavable compounds, positive-working radiation-sensitive composition containing the same and radiation-sensitive recording material prepared therefrom HOECHST AKTIENGESELLSCHAFT (DE) 1992-10-28 EP disclosed