SCHEMBL5011808

SCHEMBL5011808

CCN(CC)c1ccc(C(c2ccc(N(CC)Cc3ccccc3)cc2C)c2ccc(N(CC)Cc3ccccc3)cc2C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
CNR2 P34972 9/20 0.50
S1PR1 P21453 3/20 0.47
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
CYP2C19 P33261 1/20 0.45
CNR1 P21554 4/20 0.44
GRIA2 P42262 1/20 0.43
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
MCL1 Q07820 1/20 0.41
S100B P04271 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MITF O75030 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 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
SCHEMBL9483197 0.97 TSHR (0.53) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL11104541 0.95 TSHR (0.51) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL6252652 0.95 TSHR (0.53) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL5011923 0.92 TSHR (0.48) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL5011777 0.92 TSHR (0.56) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL9908985 0.91 S1PR1 (0.47) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL11520299 0.90 CYP2C19 (0.51) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL5010104 0.89 CNR2 (0.46) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL10596976 0.89 TSHR (0.44) TSHRCNR2S1PR1NR1H2NR1H3
SCHEMBL9780437 0.88 CYP2C19 (0.51) TSHRCNR2S1PR1NR1H2NR1H3

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 10 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-1803034-A2 HOLOGRAPHIC STORAGE MEDIUM General Electric Company (US) 2007-07-04 EP disclosed
WO-2006044243-A2 HOLOGRAPHIC STORAGE MEDIUM GENERAL ELECTRIC COMPANY A CORPORATION OF THE STATE OF NEW YORK (US) 2006-04-27 WO disclosed
US-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 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-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed