SCHEMBL3141683

SCHEMBL3141683

CCC(c1ccc(Oc2ccc(N)cc2)cc1)c1ccc(Oc2ccc(N)cc2)cc1.Nc1cccc(Oc2cccc(Oc3cccc(N)c3)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MAPT P10636 2/20 0.59
MITF O75030 1/20 0.59
GAA P10253 1/20 0.59
GFER P55789 1/20 0.59
NLRP1 Q9C000 1/20 0.59
NOD2 Q9HC29 1/20 0.59
MAOB P27338 1/20 0.57
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
NLRP3 Q96P20 1/20 0.53
MAOA P21397 1/20 0.49
CYP3A4 P08684 3/20 0.46
TP53 P04637 1/20 0.46
LTA4H P09960 1/20 0.43
ATM Q13315 1/20 0.41
TSHR P16473 2/20 0.41

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
SCHEMBL29391522 0.95 MAOB (0.62) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL556431 0.95 MAOB (0.62) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL29048706 0.90 MAOB (0.49) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL28359310 0.86 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL12112120 0.86 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL712163 0.86 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL28362166 0.84 MAOB (0.59) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7869714 0.84 MAOB (0.59) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL10476053 0.83 MAOB (0.67) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9723229 0.82 CYP3A4 (0.48) ALDH1A1MAOBMAOACYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100003531-A1 Novel polyimide film with improved adhesiveness KIKUCHI TAKASHI 2010-01-07 US disclosed
US-20080097073-A1 Novel Polyimide Film With Improved Adhesiveness KANEKA CORPORATION (JP) 2008-04-24 US disclosed