SCHEMBL499729

SCHEMBL499729

CC(C)(C)c1cccc(C(C)(C)C)c1-c1c(-c2c(C(C)(C)C)cccc2C(C)(C)C)c(-c2c(C(C)(C)C)cccc2C(C)(C)C)c2c(c1-c1c(C(C)(C)C)cccc1C(C)(C)C)=c1ccccc1=2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.43
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
KIF11 P52732 1/20 0.36
NPSR1 Q6W5P4 1/20 0.33
ALOX12 P18054 1/20 0.32
RBP4 P02753 1/20 0.31

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
SCHEMBL22042813 0.94 CA2 (0.43) CA2ALDH1A1TSHRTDP1GABRA1
SCHEMBL2051029 0.92 CA2 (0.42) CA2ALDH1A1TSHRTDP1GABRA1
SCHEMBL673853 0.82 TSHR (0.37) CA2ALDH1A1TSHRTDP1GABRA1
SCHEMBL1889673 0.82 ALDH1A1 (0.33) CA2ALDH1A1TSHRTDP1GABRA1
SCHEMBL1883326 0.82 ALDH1A1 (0.42) CA2ALDH1A1TSHRTDP1GABRA1
SCHEMBL10523675 0.81 CA2 (0.60) CA2ALDH1A1TSHRTDP1GABRA1
SCHEMBL7631189 0.78 CA2 (0.39) CA2ALDH1A1TSHRTDP1GABRA1
SCHEMBL1885153 0.77 HSPA5 (0.41) ALDH1A1TSHRTDP1
SCHEMBL1880609 0.77 ALDH1A1 (0.31) ALDH1A1TSHRTDP1
SCHEMBL28355998 0.77 CA2 (0.35) CA2ALDH1A1TSHRTDP1GABRA1

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 350 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6348163-B1 DIACID SELECTED FROM TEREPHTHALIC, CYCLOHEXANEDICARBOXYLIC, ISOPHTHALIC, BIPHENYLDICARBOXYLIC AND NAPHTHALENEDICARBOXYLIC ACIDS; DIOL SELECTED FROM HYDROQUINONE, RESORCINOL, AND BIPHENOL; AND OPTIONALLY, P-HYDROXYBENZOIC ACID, EASTMAN CHEMICAL COMPANY 2002-02-19 US claimed
WO-2024150594-A1 POLYCARBONATE RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING SAME 帝人株式会社 2024-07-18 WO disclosed
EP-4382571-A1 RESIN COMPOSITION Mitsubishi Chemical Corporation (JP) 2024-06-12 EP disclosed
CN-118159596-A Thermoplastic resin composition pellets and process for producing the same 三菱化学株式会社 2024-06-07 CN disclosed
CN-113574114-B Resin composition for infrared shielding transparent member and molded article 帝人株式会社 2024-05-28 CN disclosed
EP-3623427-B1 RESIN COMPOSITION AND MOLDED ARTICLE DAIKIN IND LTD (JP) 2024-05-22 EP disclosed
CN-117980410-A Resin composition 三菱化学株式会社 2024-05-03 CN disclosed
CN-111788257-B Polybutylene terephthalate resin composition molded article 三菱化学株式会社 2024-04-26 CN disclosed
US-20240117184-A1 POLYCARBONATE RESIN COMPOSITION AND MOLDED ARTICLE TEIJIN LIMITED (JP) 2024-04-11 US disclosed
WO-2024075642-A1 POLYCARBONATE COPOLYMER AND MOLDED ARTICLE COMPRISING SAME 帝人株式会社 2024-04-11 WO disclosed
US-6727303-B2 STYRENE-BASED RESIN, AROMATIC POLYESTER RESIN AND SILICONE; TRANSPARENCY TEIJIN CHEMICALS, LTD. (JP) 2004-04-27 US disclosed
US-6686041-B2 HIGHLY UNIFORM CONCENTRATION; NONSTREAKING; EXCELLENT INFORMATION WRITABILITY AND READABILITY TEIJIN CHEMICALS LTD (JP) 2004-02-03 US disclosed
US-20030158309-A1 Flame retardant aromatic polycarbonate resin composition and molded articles thereof TEIJIN CHEMICALS LTD. (JP) 2003-08-21 US disclosed
US-20030124351-A1 HIGHLY UNIFORM CONCENTRATION; NONSTREAKING; EXCELLENT INFORMATION WRITABILITY AND READABILITY TEIJIN CHEMICALS LTD. (JP) 2003-07-03 US disclosed
EP-1302785-A1 PLASTIC LENS Teijin Chemicals, Ltd. (JP) 2003-04-16 EP disclosed
US-20030065092-A1 Reclaimed resin composition TEIJIN CHEMICALS, LTD. (JP) 2003-04-03 US disclosed
US-20030055200-A1 Plastic lens TEIJIN CHEMICALS LTD. (JP) 2003-03-20 US disclosed
EP-1288262-A2 Flame retardant aromatic polycarbonate resin composition and molded articles thereof Teijin Chemicals, Ltd. (JP) 2003-03-05 EP disclosed
EP-1236758-A1 COLORED MASTER PELLET FOR OPTICAL MOLDINGS AND COLORED OPTICAL DISK SUBSTRATE Teijin Chemicals, Ltd. (JP) 2002-09-04 EP disclosed
EP-1191065-A1 RECLAIMED RESIN COMPOSITION Teijin Chemicals, Ltd. (JP) 2002-03-27 EP disclosed