SCHEMBL8079022

SCHEMBL8079022

CC(C)(c1ccc(OCCOc2ccc(N)cc2)cc1)c1ccc(OCCOc2ccc(N)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.59
TDP1 Q9NUW8 2/20 0.53
TSHR P16473 3/20 0.52
MAPT P10636 4/20 0.52
ALDH1A1 P00352 4/20 0.52
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
HPGD P15428 3/20 0.52
MAPK1 P28482 1/20 0.52
PSMB1 P20618 1/20 0.51
PSMB5 P28074 1/20 0.51
PSMB2 P49721 1/20 0.51
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TP53 P04637 2/20 0.47
MAOB P27338 2/20 0.47
CYP1A2 P05177 1/20 0.47
NFE2L2 Q16236 1/20 0.47
PPARG P37231 1/20 0.47
HIF1A Q16665 1/20 0.47

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
SCHEMBL8761498 0.83 MAOB (0.70) SMN1; SMN2TDP1TSHRMAPTALDH1A1
SCHEMBL8028721 0.83 MAOB (0.70) SMN1; SMN2TDP1TSHRMAPTALDH1A1
SCHEMBL3482694 0.82 TDP1 (0.64) SMN1; SMN2TDP1TSHRMAPTALDH1A1
SCHEMBL9784265 0.82 TDP1 (0.64) SMN1; SMN2TDP1TSHRMAPTALDH1A1
SCHEMBL2629379 0.82 HIF1A (0.49) SMN1; SMN2TDP1TSHRMAPTALDH1A1
SCHEMBL10883892 0.82 SMN1; SMN2 (0.83) SMN1; SMN2TSHRMAPTALDH1A1HPGD
SCHEMBL8672714 0.82 SMN1; SMN2 (0.71) SMN1; SMN2TDP1ALDH1A1NPC1RAB9A
SCHEMBL15723550 0.82 SMN1; SMN2 (0.56) SMN1; SMN2TDP1TSHRMAPTALDH1A1
SCHEMBL204685 0.81 ALDH1A1 (0.76) SMN1; SMN2TDP1TSHRMAPTALDH1A1
SCHEMBL49650 0.81 ALDH1A1 (0.76) SMN1; SMN2TDP1TSHRMAPTALDH1A1

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
JP-4059826-A None JP disclosed
US-6137008-A USEFUL AS STARTING MATERIAL FOR MAKING FLEXIBLE AROMATIC POLYAMIDES OR POLYIMIDES NATIONAL SCIENCE COUNCIL (TW) 2000-10-24 US disclosed
EP-0562824-B1 Thermal recording material FUJI PHOTO FILM CO LTD (JP) 1997-06-11 EP disclosed
US-5464804-A Heat sensitive color layer with electron donor, colorless dye is black color aminofluoran, amino compound and isocyanate compound FUJI PHOTO FILM CO., LTD. (JP) 1995-11-07 US disclosed
US-5288688-A Comprising electron-donating colorless dye, isocyanate and amino compounds; antifogging, discoloration inhibition, storage stability FUJI PHOTO FILM CO., LTD. (JP) 1994-02-22 US disclosed
JP-H0459826-A AROMATIC POLYIMIDE MOLDABLE IN MELT HITACHI CHEM CO LTD 1992-02-26 JP disclosed