SCHEMBL3033182

SCHEMBL3033182

CCCCCCCC(N)=S

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.56
SPHK1 Q9NYA1 1/20 0.56
CES2 O00748 3/20 0.48
CES1 P23141 3/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
FAAH O00519 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
SOAT1 P35610 1/20 0.46
GPR84 Q9NQS5 7/20 0.46
PPARG P37231 7/20 0.46
PPARD Q03181 7/20 0.46
PPARA Q07869 7/20 0.46
HDAC11 Q96DB2 5/20 0.46
TSHR P16473 5/20 0.46
PTPN1 P18031 3/20 0.46
ALDH1A1 P00352 2/20 0.46

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
SCHEMBL11017002 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL3661831 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL7640632 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL6836310 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL7504525 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL2531077 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL992668 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL1312624 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL10704488 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1
SCHEMBL9629897 1.00 SPHK2 (0.56) SPHK2SPHK1CES2CES1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2255377-A None JP disclosed
CN-117321042-A Oxodihydro indole compounds for the treatment of inflammatory diseases or cancers 豪夫迈·罗氏有限公司 2023-12-29 CN disclosed
US-8802713-B2 3-alkoxy-1-phenylpyrazole derivatives and pesticides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2014-08-12 US disclosed
EP-2202226-B1 3-ALKOXY-1-PHENYLPYRAZOLE DERIVATIVE AND PEST CONTROL AGENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2013-06-05 EP disclosed
US-20100210704-A1 3-ALKOXY-1-PHENYLPYRAZOLE DERIVATIVES AND PESTICIDES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-08-19 US disclosed
EP-2202226-A1 3-ALKOXY-1-PHENYLPYRAZOLE DERIVATIVE AND PEST CONTROL AGENT Kumiai Chemical Industry CO., LTD. (JP) 2010-06-30 EP disclosed
CN-101282737-A Herbal pharmaceutical composition for cartilage tissue regeneration and osteoarthritis treatment KOREA MEDICAL SCIENCE INST (KR) 2008-10-08 CN disclosed
WO-2007007958-A1 HERBAL PHARMACEUTICAL COMPOSITION FOR REGENERATIVE AGENT OF CARTILAGINOUS TISSUE AND TREATMENT OF OSTEOARTHRITIS YUHAN CORPORATION (KR) 2007-01-18 WO disclosed
EP-0765879-B1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO CO (JP) 2001-02-14 EP disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed
JP-H02255377-A THERMAL RECORDING MATERIAL FUJI PHOTO FILM CO LTD 1990-10-16 JP disclosed
US-4918122-A CONTAINING REACTION PRODUCT OF ORGANIC PHOSPHONATE AND (THIO)AMIDE CIBA-GEIGY CORPORATION (US) 1990-04-17 US disclosed
US-3959362-A Ammonium mercaptoalkanesulfonate salts, their preparation, photographic fixing solutions containing same, and method of fixing photographic film therewith EASTMAN KODAK COMPANY (US) 1976-05-25 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 (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-20100210704-A1 3-ALKOXY-1-PHENYLPYRAZOLE DERIVATIVES AND PESTICIDES HCN3, HCN4, KCNH3 SPHK2 1383/4885SPHK1 1257/4885CES2 773/4885

“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.