SCHEMBL5010140

SCHEMBL5010140

CCN(CC)c1ccc(C(NC)c2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
TSHR P16473 2/20 0.53
CNR2 P34972 11/20 0.49
MAPK1 P28482 2/20 0.48
PSMD14 O00487 1/20 0.48
CYP3A4 P08684 1/20 0.48
RECQL P46063 1/20 0.48
GFER P55789 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ALDH3A1 P30838 1/20 0.45
ALDH1A3 P47895 1/20 0.45
GRK6 P43250 1/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
NOX1 Q9Y5S8 1/20 0.41
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL13479516 0.80 ALDH1A1 (0.50) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL131813 0.78 ALDH1A1 (0.56) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL11126752 0.77 ALDH1A1 (0.65) ALDH1A1TSHRCNR2GFERMAPT
SCHEMBL12733039 0.77 ALDH1A1 (0.47) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL1735497 0.76 ALDH1A1 (0.74) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL3901638 0.76 MEN1 (0.54) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL10080950 0.76 ALDH1A1 (0.60) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL12000833 0.76 ALDH1A1 (0.54) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL4434581 0.76 ALDH1A1 (0.54) ALDH1A1TSHRCNR2MAPK1PSMD14
SCHEMBL22415842 0.75 ALDH1A1 (0.49) ALDH1A1TSHRCNR2MAPK1PSMD14

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
US-20080311524-A1 Method For Making Negative-Working Heat-Sensitive Lithographic Printing Plate Precursor AGFA GRAPHICS N.V. (BE) 2008-12-18 US disclosed
EP-0239868-B1 PHOTOCHROMIC SYSTEM, LAYER PREPARED THEREOF AND ITS USE BASF Aktiengesellschaft (DE) 1989-12-27 EP disclosed
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
EP-0239868-A1 Photochromic system, layer prepared thereof and its use BASF Aktiengesellschaft (DE) 1987-10-07 EP disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed