SCHEMBL575276

SCHEMBL575276

CC1CCCC1C1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
EPHX1 P07099 1/20 0.32
NOS1 P29475 6/20 0.31
NOS3 P29474 5/20 0.31
NOS2 P35228 5/20 0.31
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL6898227 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL598869 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL11252107 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL4616915 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL283721 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL23952890 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL6250904 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL7724695 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL6894837 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2
SCHEMBL6897202 1.00 CA1 (0.46) CA1CA2CA4ALDH1A1CYP1A2

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3660027-A1 THERMOSETTING RESIN COMPOSITION, PREPREG MADE THEREFROM, LAMINATE CLAD WITH METAL FOIL, AND HIGH-FREQUENCY CIRCUIT BOARD Shengyi Technology Co., Ltd. (CN) 2020-06-03 EP disclosed
EP-3660026-A1 THERMOSETTING RESIN COMPOSITION, PREPREG MADE THEREFROM, LAMINATE CLAD WITH METAL FOIL, AND HIGH-FREQUENCY CIRCUIT BOARD Shengyi Technology Co., Ltd. (CN) 2020-06-03 EP disclosed
US-9963451-B2 Fused ring pyrimidine compound and pest control agent containing the same MITSUI CHEMICALS AGRO, INC. (JP) 2018-05-08 US disclosed
US-20150368249-A1 FUSED RING PYRIMIDINE COMPOUND AND PEST CONTROL AGENT CONTAINING THE SAME MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2015-12-24 US disclosed
EP-2418723-A1 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same Mitsubishi Chemical Corporation (JP) 2012-02-15 EP disclosed
EP-1549668-A1 TUMOR TARGETING AGENTS AND USES THEREOF Karyon OY (FI) 2005-07-06 EP disclosed
WO-2004031221-A9 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-07-08 WO disclosed
WO-2004031219-A1 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-04-15 WO disclosed
CN-1139632-C Polypropylene resin composition and its use 三井化学株式会社 2004-02-25 CN disclosed
CN-1076031-C Polypropylene resin composition and application thereof MITSUI PETROCHEMICAL IND (JP) 2001-12-12 CN disclosed
CN-1304955-A Polypropylene resin composition and its use MITSUI CHEMICALS INC (JP) 2001-07-25 CN disclosed
CN-1102419-A Polypropylene resin composition and application thereof MITSUI PETROCHEMICAL IND (JP) 1995-05-10 CN 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 (1 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-20150368249-A1 FUSED RING PYRIMIDINE COMPOUND AND PEST CONTROL AGENT CONTAINING THE SAME CBR3, HRH2, HRH4 CA1 4146/4885CA2 2647/4885CA4 4113/4885

“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.