SCHEMBL5010085

SCHEMBL5010085

CCN(Cc1ccccc1)c1ccc(C(c2ccc(Cl)cc2)c2ccc(N(CC)Cc3ccccc3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.62
CNR2 P34972 12/20 0.54
CNR1 P21554 5/20 0.54
NR1H2 P55055 1/20 0.49
NR1H3 Q13133 1/20 0.49
CYP2C19 P33261 1/20 0.47
REN P00797 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MITF O75030 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
RAD52 P43351 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL5011841 0.91 TSHR (0.70) TSHRCNR2CNR1NR1H2NR1H3
SCHEMBL3905890 0.91 TSHR (0.70) TSHRCNR2CNR1NR1H2NR1H3
SCHEMBL5010079 0.86 TSHR (0.64) TSHRCNR2CNR1NR1H2NR1H3
SCHEMBL6553761 0.84 TSHR (0.66) TSHRCNR2CNR1NR1H2NR1H3
SCHEMBL10473223 0.84 TSHR (0.75) TSHRCNR2CNR1NR1H2NR1H3
SCHEMBL20148875 0.84 CNR2 (0.53) TSHRCNR2CNR1ALDH1A1LMNA
SCHEMBL4428266 0.81 TSHR (0.70) TSHRCNR2CNR1NR1H2NR1H3
SCHEMBL10876579 0.81 CNR2 (0.53) CNR2CNR1
SCHEMBL9908983 0.80 TSHR (0.55) TSHRCNR2CNR1NR1H2NR1H3
SCHEMBL10953799 0.80 CYP2C19 (0.60) TSHRCNR2CNR1NR1H2NR1H3

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 8 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
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