SCHEMBL1698726

SCHEMBL1698726

CN1CCN(c2ccnc(C(=O)O)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 5/20 0.54
TP53BP1 Q12888 5/20 0.51
MEN1 O00255 1/20 0.50
GLA P06280 1/20 0.50
GAA P10253 1/20 0.50
KMT2A Q03164 1/20 0.50
CHEK1 O14757 2/20 0.48
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM6B O15054 1/20 0.46
TET3 O43151 1/20 0.46
KDM4A O75164 1/20 0.46
BBOX1 O75936 1/20 0.46
MAPT P10636 1/20 0.46
KDM5A P29375 1/20 0.46
KDM5C P41229 1/20 0.46
ASPH Q12797 1/20 0.46
KDM4D Q6B0I6 1/20 0.46
TET2 Q6N021 1/20 0.46
ALKBH5 Q6P6C2 1/20 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
Ethylene SCHEMBL29031103 0.97 HRH4 (0.51) HRH4TP53BP1MEN1GLAGAA
SCHEMBL15511394 0.88 HRH4 (0.54) HRH4TP53BP1MEN1GLAGAA
SCHEMBL2533014 0.85 ALDH1A1 (0.51) HRH4MEN1GAAKMT2AKDM4E
SCHEMBL10098376 0.84 KDM4E (0.50) HRH4TP53BP1MEN1GAAKMT2A
SCHEMBL18135117 0.84 HRH4 (0.50) HRH4TP53BP1MEN1GLAGAA
SCHEMBL31704499 0.84 MAPT (0.50) TP53BP1MEN1GAAKMT2AKDM4E
Hydrochloric Acid SCHEMBL14876289 0.83 KDM4E (0.49) HRH4TP53BP1MEN1GAAKMT2A
SCHEMBL14882840 0.82 HRH4 (0.49) HRH4TP53BP1MEN1GLAGAA
SCHEMBL10098367 0.81 KMO (0.57) MEN1GAAKMT2AKDM4EALDH1A1
SCHEMBL28544347 0.80 HRH4 (0.48) HRH4TP53BP1MEN1GLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12161649-B2 Inhibitors of EGFR and methods of use thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-12-10 US disclosed
EP-3810596-B1 QUINOLINE DERIVATIVES USEFUL AS TYROSINE KINASE INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2022-11-30 EP disclosed
US-20210346395-A1 INHIBITORS OF EGFR AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. 2021-11-11 US disclosed
US-20210346395-A1 INHIBITORS OF EGFR AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. 2021-11-11 US disclosed
EP-3810596-A1 QUINOLINE DERIVATIVES USEFUL AS TYROSINE KINASE INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2021-04-28 EP disclosed
US-20210078990-A1 TYROSINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2021-03-18 US disclosed
CN-112513030-A Quinoline derivatives as tyrosine kinase inhibitors 里格尔药品股份有限公司 2021-03-16 CN disclosed
US-10851093-B2 Tyrosine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2020-12-01 US disclosed
US-9296722-B2 Azolyl urea compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2016-03-29 US disclosed
US-20130310357-A1 Azolyl Urea Compounds and Methods of Use Thereof AMBIT BIOSCIENCES CORPORATION (US) 2013-11-21 US disclosed
WO-2011150198-A1 AZOLYL UREA COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2011-12-01 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 (5 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-10851093-B2 Tyrosine kinase inhibitors TYRO3, RET, AXL HRH4 883/4885TP53BP1 1657/4885MEN1 1216/4885
US-12161649-B2 Inhibitors of EGFR and methods of use thereof EGFR, ERBB2, ERBB3 HRH4 945/4885TP53BP1 564/4885MEN1 3498/4885
US-20210346395-A1 INHIBITORS OF EGFR AND METHODS OF USE THEREOF EGFR, ERBB2, ERBB3 HRH4 945/4885TP53BP1 564/4885MEN1 3498/4885
US-20130310357-A1 Azolyl Urea Compounds and Methods of Use Thereof CSF1R, CSF3R, ARG1 HRH4 223/4885TP53BP1 2839/4885MEN1 2367/4885
US-20210078990-A1 TYROSINE KINASE INHIBITORS TYRO3, RET, AXL HRH4 883/4885TP53BP1 1657/4885MEN1 1216/4885

“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.