SCHEMBL16705253

SCHEMBL16705253

CCCC(C)(C)CCCNC

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.46
ALDH1A1 P00352 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL20629328 0.93 EPHX1 (0.50) EPHX1ALDH1A1SIGMAR1L3MBTL1
SCHEMBL17424948 0.91 EPHX1 (0.54) EPHX1SIGMAR1
SCHEMBL14018455 0.90 EPHX1 (0.52) EPHX1ALDH1A1SIGMAR1
SCHEMBL24042407 0.89 EPHX1 (0.52) EPHX1SIGMAR1
SCHEMBL22403813 0.88 EPHX1 (0.56) EPHX1ALDH1A1
SCHEMBL21398350 0.86 EPHX1 (0.61) EPHX1ALDH1A1
SCHEMBL18602993 0.84 EPHX1 (0.38) EPHX1
SCHEMBL22111696 0.83 EPHX1 (0.56) EPHX1ALDH1A1SIGMAR1L3MBTL1
SCHEMBL18685898 0.82 EPHX1 (0.42) EPHX1SIGMAR1
SCHEMBL20644846 0.81 EPHX1 (0.61) EPHX1ALDH1A1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10835536-B2 Therapeutic agent for FGFR inhibitor-resistant cancer TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-11-17 US disclosed
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2020-06-18 US disclosed
EP-3157942-B1 SITE SPECIFIC PROTEIN MODIFICATIONS NOVARTIS AG (CH) 2020-06-17 EP disclosed
US-20190350932-A1 PREPARATION AND COMPOSITION FOR TREATMENT OF MALIGNANT TUMORS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2019-11-21 US disclosed
US-20190015417-A1 THERAPEUTIC AGENT FOR FGFR INHIBITOR-RESISTANT CANCER TAIHO PHARMACEUTICAL CO., LTD. (JP) 2019-01-17 US disclosed
WO-2017147410-A1 COMPOUNDS THAT INHIBIT MCL-1 PROTEIN AMGEN INC. (US) 2017-08-31 WO disclosed
EP-1673087-B1 ALKOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2015-05-13 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-20190015417-A1 THERAPEUTIC AGENT FOR FGFR INHIBITOR-RESISTANT CANCER FGFR1, FGFR3, FGFR4 EPHX1 2513/4885ALDH1A1 94/4885SIGMAR1 4807/4885
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF ATG7, SQSTM1, BECN1 EPHX1 4533/4885ALDH1A1 4264/4885SIGMAR1 3139/4885
US-10835536-B2 Therapeutic agent for FGFR inhibitor-resistant cancer FGFR1, FGFR3, FGFR4 EPHX1 2513/4885ALDH1A1 94/4885SIGMAR1 4807/4885
US-20190350932-A1 PREPARATION AND COMPOSITION FOR TREATMENT OF MALIGNANT TUMORS FGFR3, FGFR1, FGFR4 EPHX1 2024/4885ALDH1A1 1665/4885SIGMAR1 4692/4885

“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.