SCHEMBL15345752

SCHEMBL15345752

CC(C)(C)OC(=O)N1CC(n2cc(I)c3c(Cl)ncnc32)C1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 13/20 0.48
EGFR P00533 3/20 0.48
ADK P55263 5/20 0.46
ABL1 P00519 2/20 0.45
ABL2 P42684 2/20 0.45
SLC29A1 Q99808 1/20 0.42
PIK3CD O00329 1/20 0.38
POLB P06746 1/20 0.37

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
SCHEMBL29588478 1.00 SRC (0.48) SRCEGFRADKABL1ABL2
SCHEMBL1442315 0.92 SRC (0.59) SRCEGFRADKABL1ABL2
SCHEMBL29588466 0.92 SRC (0.59) SRCEGFRADKABL1ABL2
SCHEMBL15345425 0.92 SRC (0.59) SRCEGFRADKABL1ABL2
SCHEMBL1442313 0.92 SRC (0.59) SRCEGFRADKABL1ABL2
SCHEMBL29588435 0.92 SRC (0.59) SRCEGFRADKABL1ABL2
SCHEMBL29589197 0.92 SRC (0.59) SRCEGFRADKABL1ABL2
SCHEMBL15516700 0.90 SRC (0.53) SRCEGFRADKABL1ABL2
SCHEMBL13858155 0.90 SRC (0.53) SRCEGFRADKABL1ABL2
SCHEMBL29503465 0.89 SRC (0.52) SRCEGFRADKABL1ABL2

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109328187-B Novel compound with FGFR (FGFR) inhibitory activity as well as preparation and application thereof 中国科学院上海药物研究所 2022-04-26 CN disclosed
CN-113768935-A Prophylactic and/or therapeutic agent for immune diseases 大鹏药品工业株式会社 2021-12-10 CN disclosed
CN-113683629-A Substituted heteroaryl compounds, compositions and uses thereof 北京范恩柯尔生物科技有限公司 2021-11-23 CN disclosed
CN-107206001-B Prophylactic and/or therapeutic agent for immune diseases 大鹏药品工业株式会社 2021-09-28 CN disclosed
CN-110036014-B Compound with AXL inhibitory activity and preparation and application thereof 中国科学院上海药物研究所 2021-09-07 CN disclosed
US-10894048-B2 Antitumor drug for intermittent administration of FGFR inhibitor TAIHO PHARMACEUTICAL CO., LTD. (JP) 2021-01-19 US disclosed
US-10835536-B2 Therapeutic agent for FGFR inhibitor-resistant cancer TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-11-17 US disclosed
EP-3023101-B1 THERAPEUTIC AGENT FOR FGFR INHIBITOR-RESISTANT CANCER TAIHO PHARMACEUTICAL CO LTD (JP) 2020-08-19 EP disclosed
US-20190183897-A1 ANTITUMOR DRUG FOR INTERMITTENT ADMINISTRATION OF FGFR INHIBITOR TAIHO PHARMACEUTICAL CO., LTD. (JP) 2019-06-20 US disclosed
EP-3486244-A1 NEW COMPOUND HAVING FGFR INHIBITORY ACTIVITY AND PREPARATION AND APPLICATION THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2019-05-22 EP disclosed
EP-3023101-A1 THERAPEUTIC AGENT FOR FGFR INHIBITOR-RESISTANT CANCER Taiho Pharmaceutical Co., Ltd. (JP) 2016-05-25 EP disclosed
EP-3023100-A1 ANTITUMOR DRUG FOR INTERMITTENT ADMINISTRATION OF FGFR INHIBITOR Taiho Pharmaceutical Co., Ltd. (JP) 2016-05-25 EP disclosed
US-20160136168-A1 THERAPEUTIC AGENT FOR FGFR INHIBITOR-RESISTANT CANCER TAIHO PHARMACEUTICAL CO., LTD. (JP) 2016-05-19 US disclosed
US-20160115168-A1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2016-04-28 US disclosed
US-20160115168-A1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2016-04-28 US disclosed
EP-2947086-A1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2015-11-25 EP disclosed
US-9108973-B2 3,5-disubstituted alkynylbenzene compound and salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-08-18 US disclosed
US-20140343035-A1 3,5-DISUBSTITUTED ALKYNYLBENZENE COMPOUND AND SALT THEREOF TAIHO PHARMACEUTICAL CO.,LTD. (JP) 2014-11-20 US disclosed
EP-2657233-B1 3,5-DISUBSTITUTED ALKYNYLBENZENE COMPOUND AND SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2014-08-27 EP disclosed
EP-2657233-A1 3,5-DISUBSTITUTED ALKYNYLBENZENE COMPOUND AND SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2013-10-30 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 (6 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-20190183897-A1 ANTITUMOR DRUG FOR INTERMITTENT ADMINISTRATION OF FGFR INHIBITOR FGFR1, FGFR3, FGFR2 SRC 54/4885EGFR 27/4885ADK 2280/4885
US-20160136168-A1 THERAPEUTIC AGENT FOR FGFR INHIBITOR-RESISTANT CANCER FGFR1, FGFR3, FGFR4 SRC 48/4885EGFR 14/4885ADK 2126/4885
US-10894048-B2 Antitumor drug for intermittent administration of FGFR inhibitor FGFR1, FGFR3, FGFR2 SRC 54/4885EGFR 27/4885ADK 2280/4885
US-20140343035-A1 3,5-DISUBSTITUTED ALKYNYLBENZENE COMPOUND AND SALT THEREOF NFXL1, ZFX, CXXC5 SRC 306/4885EGFR 1467/4885ADK 4572/4885
US-10835536-B2 Therapeutic agent for FGFR inhibitor-resistant cancer FGFR1, FGFR3, FGFR4 SRC 48/4885EGFR 14/4885ADK 2126/4885
US-20160115168-A1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF BTK, JAK2, SYK SRC 18/4885EGFR 839/4885ADK 1351/4885

“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.