SCHEMBL8777790

SCHEMBL8777790

CCn1c(C)c(C(OC)c2ccc(N(C)C)cc2)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.43
ALDH1A1 P00352 7/20 0.41
MAPT P10636 5/20 0.41
HTT P42858 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPSR1 Q6W5P4 3/20 0.41
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
GFER P55789 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GRIK2 Q13002 1/20 0.36
GAA P10253 3/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL8777552 0.91 CYP19A1 (0.43) CYP19A1ALDH1A1MAPTHTTMEN1
SCHEMBL8777527 0.89 CYP19A1 (0.42) CYP19A1ALDH1A1MAPTHTTMEN1
SCHEMBL10834698 0.88 CYP19A1 (0.41) CYP19A1ALDH1A1MAPTHTTMEN1
SCHEMBL8777753 0.88 CNR2 (0.42) ALDH1A1HTTNPSR1KDM4EMAPK1
SCHEMBL8777573 0.87 ALDH1A1 (0.45) CYP19A1ALDH1A1MAPTMEN1KMT2A
SCHEMBL10834701 0.87 CYP19A1 (0.41) CYP19A1ALDH1A1MAPTHTTMEN1
SCHEMBL8777617 0.87 ALDH1A1 (0.38) CYP19A1ALDH1A1MAPTHTTMEN1
SCHEMBL10835395 0.86 CYP19A1 (0.40) CYP19A1ALDH1A1MAPTHTTMEN1
SCHEMBL8777632 0.85 CYP19A1 (0.39) CYP19A1ALDH1A1MAPTHTTMEN1
SCHEMBL10835401 0.85 CYP19A1 (0.39) CYP19A1ALDH1A1MAPTHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587184-B1 Pressure sensitive recording materials NEW OJI PAPER CO LTD (JP) 1997-12-29 EP disclosed
US-5478793-A Basic dye-containing layer and color accetpor-containing layer formed on same or different surfaces; basic dye enclosed in synthetic polymer microcapsules, color acceptor is activated clay containing silica KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1995-12-26 US disclosed
EP-0587184-A2 Pressure sensitive recording materials NEW OJI PAPER CO., LTD. (JP) 1994-03-16 EP disclosed
US-4618684-A Substituted indoles THE HILTON-DAVIS CHEMICAL CO. (US) 1986-10-21 US disclosed
US-4485242-A PRESSURE SENSITIVE CARBONLESS REPRODUCTION STERLING DRUG INC. (US) 1984-11-27 US disclosed
US-4307898-A INDOLES STERLING DRUG INC. (US) 1981-12-29 US disclosed
EP-0035774-A2 Indoles, process for preparing them and duplicating or marking systems containing them STERLING DRUG INC. (US) 1981-09-16 EP disclosed