SCHEMBL9634110

SCHEMBL9634110

CCCCCCC([CH]CC(CC)CCCC)CCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 2/20 0.43
TSHR P16473 5/20 0.42
CYP3A4 P08684 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DNM1 Q05193 2/20 0.38
CA2 P00918 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
ADH7 P40394 1/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL10686241 0.94 ALDH1A1 (0.42) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL17674241 0.92 ALDH1A1 (0.39) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL8464662 0.92 LMNA (0.46) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL8838785 0.88 ALDH1A1 (0.46) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL3397923 0.88 TSHR (0.50) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL6154186 0.81 TSHR (0.52) ALDH1A1TDP1TSHRCYP3A4SMN1; SMN2
SCHEMBL16295209 0.80 LMNA (0.43) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL9092266 0.78 ALDH1A1 (0.59) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL3689153 0.78 ALDH1A1 (0.59) ALDH1A1TDP1LMNATSHRCYP3A4
SCHEMBL20746322 0.78 ALDH1A1 (0.59) ALDH1A1TDP1LMNATSHRCYP3A4

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
EP-0162016-B1 ADDITIVES FOR MATERIALS CIBA-GEIGY AG (CH) 1992-06-03 EP claimed
US-4737300-A LUBRICANTS, STABILIZERS CIBA-GEIGY CORPORATION (US) 1988-04-12 US claimed
EP-0162016-B1 ADDITIVES FOR MATERIALS CIBA-GEIGY AG (CH) 1992-06-03 EP disclosed
US-4737300-A LUBRICANTS, STABILIZERS CIBA-GEIGY CORPORATION (US) 1988-04-12 US disclosed
EP-0162016-A2 Additives for materials CIBA-GEIGY AG (CH) 1985-11-21 EP disclosed