SCHEMBL4126243

SCHEMBL4126243

CC(C)(C)[Si](OCC1(C=O)CCC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.36
CYP3A4 P08684 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ABL1 P00519 1/20 0.33
TP53 P04637 1/20 0.31
MDM2 Q00987 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
SCHEMBL4120223 0.97 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL4119132 0.96 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL187156 0.94 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL4120876 0.87 SMYD2 (0.33) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL16569484 0.85 SMYD2 (0.38) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL4127225 0.85 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL31216597 0.84 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL31297853 0.83 SMYD2 (0.32) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL17768518 0.83 ABL1 (0.34) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL8612535 0.81 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119241408-A Trifluoro methyl sulfide molecule as HIF2a inhibitor 维眸生物科技(浙江)有限公司 2025-01-03 CN disclosed
CN-117321052-A Alkyne compound as HPK1 inhibitor and application thereof 南京再明医药有限公司 2023-12-29 CN disclosed
WO-2022228522-A1 ALKYNE COMPOUND AS HPK1 INHIBITOR AND USE THEREOF 江苏先声药业有限公司 2022-11-03 WO disclosed
US-11434205-B2 Substituted imidazole carboxylate derivatives and the use thereof CHENGDU MFS PHARMA. CO., LTD. (CN) 2022-09-06 US disclosed
EP-3747869-A1 SUBSTITUTED IMIDAZOLE FORMATE DERIVATIVE AND USE THEREOF CHENGDU MFS PHARMA. CO., LTD. (CN) 2020-12-09 EP disclosed
US-20200369621-A1 SUBSTITUTED IMIDAZOLECARBOXYLATE DERIVATIVES AND THE USE THEREOF CHENGDU MFS PHARMA. CO., LTD. (CN) 2020-11-26 US disclosed
CN-109776512-A N-substituted imidazole formate derivative and application thereof 成都安诺晨创医药科技有限公司 2019-05-21 CN disclosed
EP-3221300-B1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2019-03-20 EP disclosed
US-20170355687-A1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2017-12-14 US disclosed
EP-3221300-A1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES Actelion Pharmaceuticals Ltd (CH) 2017-09-27 EP disclosed
WO-2016079688-A1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2016-05-26 WO disclosed
US-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 US disclosed
EP-2017275-A1 BENZISOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2009-01-21 EP 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 (4 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-20090318690-A1 Benzisoxazole Compound NR1I2, NR1I3, NR0B1 SMYD2 3091/4885CYP3A4 157/4885HTT 3905/4885
US-11434205-B2 Substituted imidazole carboxylate derivatives and the use thereof SLC6A11, SLC6A13, SLC6A1 SMYD2 3646/4885CYP3A4 12/4885HTT 3786/4885
US-20200369621-A1 SUBSTITUTED IMIDAZOLECARBOXYLATE DERIVATIVES AND THE USE THEREOF SLC6A13, SLC6A11, SLC6A1 SMYD2 2738/4885CYP3A4 11/4885HTT 3376/4885
US-20170355687-A1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES CYP8B1, TUBB, DRD3 SMYD2 1795/4885CYP3A4 1095/4885HTT 853/4885

“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.