SCHEMBL993913

SCHEMBL993913

CON1C(C)(C)CC(C(CCCCCCCC(=O)O)(C(=O)O)C2CC(C)(C)N(OC)C(C)(C)C2)CC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
TSHR P16473 5/20 0.32
LMNA P02545 1/20 0.32
NFKB1 P19838 1/20 0.32
PMP22 Q01453 1/20 0.32
TBXAS1 P24557 2/20 0.32
SCD O00767 1/20 0.31
GPR84 Q9NQS5 7/20 0.31
PPARG P37231 7/20 0.31
PPARD Q03181 7/20 0.31
PPARA Q07869 7/20 0.31
HDAC11 Q96DB2 5/20 0.31
PTPN1 P18031 3/20 0.31
TLR2 O60603 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
FABP4 P15090 2/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
SLC22A8 Q8TCC7 1/20 0.31
MEN1 O00255 1/20 0.31
ESR1 P03372 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
SCHEMBL9589736 0.95 ALDH1A1 (0.32) ALDH1A1
SCHEMBL15911950 0.91 ALDH1A1 (0.33) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL9590497 0.89 PPARG (0.35) ALDH1A1TSHRSCDGPR84PPARG
SCHEMBL1888658 0.87 TSHR (0.38) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL9737855 0.87 TBXAS1 (0.35) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL995190 0.87 GPR84 (0.33) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL9242329 0.86 EPHX2 (0.30)
SCHEMBL7118388 0.85 ALDH1A1 (0.32) ALDH1A1GPR84FFAR1FFAR4
SCHEMBL994981 0.85 PPARG (0.34) ALDH1A1TSHRSCDGPR84PPARG
SCHEMBL1138877 0.85 TBXAS1 (0.32) TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0309402-B2 N-substituted hindered amine stabilizers CIBA SC HOLDING AG (CH) 2002-06-12 EP claimed
EP-0309402-B1 N-substituted hindered amine stabilizers CIBA GEIGY AG (CH) 1995-01-11 EP claimed
US-5112890-A Piperidine compound with oxygen bonded to ring nitrogen CIBA-GEIGY CORPORATION (US) 1992-05-12 US claimed
WO-2024185433-A1 ACTIVE ENERGY RAY CURABLE COMPOSITION, LAMINATE, AND METHOD FOR MANUFACTURING LAMINATE DIC株式会社 2024-09-12 WO disclosed
EP-2602300-B1 PHOTOCHROMIC COMPOSITION TOKUYAMA CORP (JP) 2019-06-12 EP disclosed
US-10040945-B2 Active energy ray curable resin composition, resin molded article, and method for producing resin molded article MITSUBISHI CHEMICAL CORPORATION (JP) 2018-08-07 US disclosed
EP-2799514-B1 PHOTOCHROMIC COMPOSITION TOKUYAMA CORP (JP) 2017-08-02 EP disclosed
US-20170130057-A1 ACTIVE ENERGY BEAM-CURABLE RESIN COMPOSITION, RESIN MOLDED ARTICLES, AND METHOD FOR PRODUCING RESIN MOLDED ARTICLES MITSUBISHI RAYON CO., LTD. (JP) 2017-05-11 US disclosed
US-9316765-B2 Photochromic composition TOKUYAMA CORPORATION (JP) 2016-04-19 US disclosed
US-9234984-B2 Photochromic composition TOKUYAMA CORPORATION (JP) 2016-01-12 US disclosed
US-20150299529-A1 FIRE-RESISTANT ADHESIVE TAPE, FIRE-RESISTANT CONSTRUCTION MATERIAL AND FIRE-RESISTANT TREATMENT METHOD NITTO DENKO CORPORATION (JP) 2015-10-22 US disclosed
US-20110038816-A1 Ultraviolet light absorbing ketones of 2-(2-hydroxyhenyl) benzotriazole CHANG CHIA-HU 2011-02-17 US disclosed
US-20110009518-A1 Photosetting type bio-based coating composition and its coated article NIPPON BEE CHEMICAL CO., LTD. (JP) 2011-01-13 US disclosed
US-7847103-B2 Ultraviolet light absorbing ketones of 2-(2-hydroxyphenyl) benzotriazole CHANG CHIA-HU 2010-12-07 US disclosed
US-7785713-B2 Active energy ray-curable coating composition and molded article having cured coating film of the composition MITSUBISHI RAYON CO., LTD. (JP) 2010-08-31 US disclosed
US-20100086500-A1 Ultraviolet light absorbing ketones of 2-(2-Hydroxyphenyl) benzotriazole CHANG CHIA-HU 2010-04-08 US disclosed
WO-2010039229-A1 ULTRAVIOLET LIGHT ABSORBING KETONES OF 2-(2-HYDROXYPHENYL) BENZOTRIAZOLE CHANG CHIA-HU (US) 2010-04-08 WO disclosed
US-20090111904-A1 ACTIVE ENERGY RAY-CURABLE COATING COMPOSITION AND MOLDED ARTICLE HAVING CURED COATING FILM OF THE COMPOSITION MITSUBISHI RAYON CO., LTD. (JP) 2009-04-30 US disclosed
EP-2011837-A1 ACTIVE ENERGY RAY-CURABLE COATING COMPOSITION AND MOLDED ARTICLE HAVING CURED COATING FILM OF THE COMPOSITION Mitsubishi Rayon Co., Ltd. (JP) 2009-01-07 EP disclosed
US-20080076883-A1 Acrylic resin having a hydrolysable silyl group, a hydroxyl group and a polysiloxane chain; an organopolysiloxane having a hydrolysable silyl group; and an organopolysiloxane not having a hydrolysable silyl group; conceals scratches on surfaces to be painted of automobile bodies KANSAI PAINT CO., LTD. (JP) 2008-03-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110038816-A1 Ultraviolet light absorbing ketones of 2-(2-hydroxyhenyl) benzotriazole HCRTR2, HCRTR1, POLL ALDH1A1 94/4885TSHR 983/4885LMNA 2395/4885
US-20100086500-A1 Ultraviolet light absorbing ketones of 2-(2-Hydroxyphenyl) benzotriazole HCRTR2, HCRTR1, PAH ALDH1A1 85/4885TSHR 996/4885LMNA 2377/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.