SCHEMBL6524121

SCHEMBL6524121

[O]Cc1c[nH]c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.69
KMT2A Q03164 6/20 0.69
MAPT P10636 4/20 0.69
CYP3A4 P08684 3/20 0.69
AHR P35869 1/20 0.69
GPR84 Q9NQS5 1/20 0.69
TDP1 Q9NUW8 1/20 0.69
HTR2A P28223 4/20 0.60
CYP2D6 P10635 3/20 0.60
HTR2C P28335 3/20 0.60
HTR1D P28221 2/20 0.60
HTR1B P28222 2/20 0.60
HTR7 P34969 2/20 0.60
HTR6 P50406 2/20 0.60
MPO P05164 1/20 0.60
CYP1A2 P05177 1/20 0.60
CYP2A6 P11509 1/20 0.60
NFKB1 P19838 1/20 0.60
CTSK P43235 1/20 0.60
CYP2A13 Q16696 1/20 0.60

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
SCHEMBL5513682 0.83 HTR2A (0.67) MEN1KMT2AMAPTCYP3A4AHR
SCHEMBL5020054 0.83 MEN1 (0.69) MEN1KMT2AMAPTCYP3A4AHR
SCHEMBL29413080 0.83 MEN1 (0.69) MEN1KMT2AMAPTCYP3A4AHR
SCHEMBL90504 0.83 MEN1 (0.69) MEN1KMT2AMAPTCYP3A4AHR
Arundine SCHEMBL325162 0.82 MEN1 (1.00) MEN1KMT2AMAPTCYP3A4AHR
SCHEMBL4985934 0.82 HTR2A (0.77) MEN1KMT2AMAPTCYP3A4AHR
Indole-3-Carbinol SCHEMBL29350358 0.80 MEN1 (0.72) MEN1KMT2AMAPTCYP3A4AHR
Arundine SCHEMBL28335217 0.80 MEN1 (0.95) MEN1KMT2AMAPTCYP3A4AHR
Indole-3-Carbinol SCHEMBL2867957 0.80 MEN1 (0.72) MEN1KMT2AMAPTCYP3A4AHR
Indole-3-Carbinol SCHEMBL195520 0.80 MEN1 (0.72) MEN1KMT2AMAPTCYP3A4AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190010159-A1 NOVEL KINASE INHIBITOR AGAINST WILD-TYPE AND MUTANT EGFR PRECEDO PHARMACEUTICALS CO., LTD (CN) 2019-01-10 US claimed
EP-3398950-A1 NOVEL KINASE INHIBITOR AGAINST WILD-TYPE EGFR AND MUTATED EGFR Precedo Pharmaceuticals Co., Ltd. (CN) 2018-11-07 EP claimed
EP-3398950-B1 NOVEL KINASE INHIBITOR AGAINST WILD-TYPE EGFR AND MUTATED EGFR PRECEDO PHARMACEUTICALS CO LTD (CN) 2021-08-11 EP disclosed
CN-106928231-B Novel EGFR wild type and mutant kinase inhibitors 合肥中科普瑞昇生物医药科技有限公司 2021-06-01 CN disclosed
US-10781214-B2 Kinase inhibitor against wild-type and mutant EGFR PRECEDO PHARMACEUTICALS CO., LTD. (CN) 2020-09-22 US disclosed
US-20190010159-A1 NOVEL KINASE INHIBITOR AGAINST WILD-TYPE AND MUTANT EGFR PRECEDO PHARMACEUTICALS CO., LTD (CN) 2019-01-10 US disclosed
EP-3398950-A1 NOVEL KINASE INHIBITOR AGAINST WILD-TYPE EGFR AND MUTATED EGFR Precedo Pharmaceuticals Co., Ltd. (CN) 2018-11-07 EP disclosed
US-20050171094-A1 Pyrrolopyrimidine derivatives TEIJIN, LIMITED (JP) 2005-08-04 US disclosed
EP-1477490-A1 PYRROLOPYRIMIDINE DERIVATIVE TEIJIN LIMITED (JP) 2004-11-17 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 (3 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-20190010159-A1 NOVEL KINASE INHIBITOR AGAINST WILD-TYPE AND MUTANT EGFR EGFR, ERBB2, ERBB3 MEN1 4409/4885KMT2A 3292/4885MAPT 4560/4885
US-10781214-B2 Kinase inhibitor against wild-type and mutant EGFR EGFR, ERBB2, ERBB3 MEN1 4499/4885KMT2A 3015/4885MAPT 4503/4885
US-20050171094-A1 Pyrrolopyrimidine derivatives GSK3B, GSK3A, GSKIP MEN1 3834/4885KMT2A 1064/4885MAPT 296/4885

“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.