SCHEMBL7537633

SCHEMBL7537633

CC(C)CCCC(C)CCSc1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.45
KMT2A Q03164 4/20 0.43
HPGD P15428 3/20 0.43
MEN1 O00255 2/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 2/20 0.42
GRM2 Q14416 1/20 0.41
SMN1; SMN2 Q16637 6/20 0.40
NPC1 O15118 5/20 0.39
RAB9A P51151 5/20 0.39
EHMT2 Q96KQ7 1/20 0.39
EHMT1 Q9H9B1 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL15270800 0.87 ALDH1A1 (0.53) ALDH1A1KMT2AHPGDMEN1TSHR
SCHEMBL26006077 0.83 ALDH1A1 (0.49) ALDH1A1KMT2AHPGDMEN1TSHR
SCHEMBL4761158 0.76 ALDH1A1 (0.48) ALDH1A1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL18519770 0.75 EHMT2 (0.50) ALDH1A1KMT2AHPGDMEN1TSHR
SCHEMBL2608954 0.75 KMT2A (0.58) ALDH1A1KMT2AHPGDMEN1TSHR
SCHEMBL405697 0.74 EHMT2 (0.48) ALDH1A1KMT2AHPGDMEN1TSHR
SCHEMBL21575588 0.73 LMNA (0.50) ALDH1A1KMT2AHPGDMEN1LMNA
Ammonia Solution, Strong SCHEMBL7245354 0.73 KMT2A (0.57) ALDH1A1KMT2AHPGDMEN1TSHR
SCHEMBL4760044 0.73 LMNA (0.42) ALDH1A1KMT2AMEN1MAPTGRM2
SCHEMBL422519 0.72 ALDH1A1 (0.54) ALDH1A1KMT2AHPGDMEN1TSHR

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
EP-1204320-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS Bioparken AS (NO) 2002-05-15 EP claimed
WO-2001006853-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS BIOPARKEN AS (NO) 2001-02-01 WO claimed
EP-1204320-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS Bioparken AS (NO) 2002-05-15 EP disclosed
EP-1204413-A2 CONTROL OF CRUSTACEAN INFESTATION OF AQUATIC ANIMALS Bioparken AS (NO) 2002-05-15 EP disclosed
WO-2001006853-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS BIOPARKEN AS (NO) 2001-02-01 WO disclosed
WO-2001007047-A2 CONTROL OF CRUSTACEAN INFESTATION OF AQUATIC ANIMALS BIOPARKEN AS (NO) 2001-02-01 WO disclosed