SCHEMBL627496

SCHEMBL627496

NC(=S)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
CES2 O00748 1/20 0.54
CTSL P07711 4/20 0.45
CTSB P07858 4/20 0.45
ALDH1A1 P00352 1/20 0.44
ITGB3 P05106 1/20 0.42
ITGAV P06756 1/20 0.42
ASH1L Q9NR48 1/20 0.42
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KMT2A Q03164 1/20 0.39
IDO1 P14902 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38

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
SCHEMBL3587775 0.90 GAA (0.49) GAACES2CTSLCTSBALDH1A1
SCHEMBL12128243 0.87 GAA (0.46) GAACES2CTSLCTSBALDH1A1
SCHEMBL11298235 0.86 GAA (0.53) GAACES2CTSLCTSBALDH1A1
SCHEMBL628459 0.86 ALDH1A1 (0.46) GAACES2CTSLCTSBALDH1A1
SCHEMBL12128276 0.86 CTSL (0.47) GAACES2CTSLCTSBALDH1A1
SCHEMBL1198001 0.86 NOTUM (0.53) GAACES2CTSLCTSBALDH1A1
SCHEMBL11954589 0.82 GAA (0.50) GAACES2CTSLCTSBALDH1A1
SCHEMBL16283601 0.82 GAA (0.42) GAACES2CTSLCTSBALDH1A1
SCHEMBL628084 0.81 RXRA (0.43) GAACTSLCTSBALDH1A1ASH1L
SCHEMBL11300330 0.80 GAA (0.44) GAACES2MAPTLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116514773-B Verdinexor (KPT-335) and synthesis method of hydrochloride thereof 重庆汉佩生物科技有限公司 2024-12-03 CN claimed
CN-116514773-A Verdinexor (KPT-335) and synthesis method of hydrochloride thereof 重庆汉佩生物科技有限公司 2023-08-01 CN claimed
US-11318120-B2 Nuclear transport modulators and uses thereof BIOGEN MA INC. (US) 2022-05-03 US claimed
US-20210251968-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF BIOGEN MA INC. (US) 2021-08-19 US claimed
US-12577225-B2 Nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2026-03-17 US disclosed
US-20260062391-A1 HYDRAZIDE CONTAINING NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS INC (US) 2026-03-05 US disclosed
US-12291508-B2 Hydrazide containing nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2025-05-06 US disclosed
US-20250059158-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF WILMINGTON SAVINGS FUND SOCIETY, FSB, AS AGENT 2025-02-20 US disclosed
EP-3663291-B1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS INC (US) 2024-12-18 EP disclosed
CN-116514773-B Verdinexor (KPT-335) and synthesis method of hydrochloride thereof 重庆汉佩生物科技有限公司 2024-12-03 CN disclosed
US-20240376114-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF WILMINGTON SAVINGS FUND SOCIETY, FSB, AS AGENT 2024-11-14 US disclosed
US-20240279188-A1 HYDRAZIDE CONTAINING NUCLEAR TRANSPORT MODULATORS AND USES THEREOF WILMINGTON SAVINGS FUND SOCIETY, FSB, AS AGENT 2024-08-22 US disclosed
EP-2419412-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-02-22 EP disclosed
US-20110275607-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS, INC. (US) 2011-11-10 US disclosed
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
WO-2010120741-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (US) 2010-10-21 WO disclosed
EP-1962605-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS Merck & Co., Inc. (US) 2008-09-03 EP disclosed
WO-2007070433-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-06-21 WO disclosed
WO-2007070433-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-06-21 WO 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 (10 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-20210251968-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, XPO5, XPOT GAA 1566/4885CES2 3871/4885CTSL 4729/4885
US-20240376114-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, XPO5, XPOT GAA 2114/4885CES2 4047/4885CTSL 4822/4885
US-20110275607-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, NXF1, XPOT GAA 3958/4885CES2 4629/4885CTSL 4706/4885
US-12577225-B2 Nuclear transport modulators and uses thereof XPO1, XPOT, CSE1L GAA 4336/4885CES2 4215/4885CTSL 4303/4885
US-11318120-B2 Nuclear transport modulators and uses thereof XPO1, XPO5, XPOT GAA 1566/4885CES2 3871/4885CTSL 4729/4885
US-20260062391-A1 HYDRAZIDE CONTAINING NUCLEAR TRANSPORT MODULATORS AND USES THEREOF SLC8A1, SLC9A1, SLC8B1 GAA 3813/4885CES2 2337/4885CTSL 4575/4885
US-20240279188-A1 HYDRAZIDE CONTAINING NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, KPNA1, ABCB11 GAA 1990/4885CES2 3364/4885CTSL 4846/4885
US-20250059158-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, XPO5, XPOT GAA 1013/4885CES2 3820/4885CTSL 4751/4885
US-12291508-B2 Hydrazide containing nuclear transport modulators and uses thereof XPO1, KPNA1, ABCB11 GAA 1990/4885CES2 3364/4885CTSL 4846/4885
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CXCR2 GAA 4433/4885CES2 3076/4885CTSL 4243/4885

“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.