SCHEMBL3511228

SCHEMBL3511228

O=C(Nc1n[nH]c2ccc(Cc3cc(F)cc(F)c3)cc12)c1ccc(N2CCNCC2)cc1NC1CCOCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INSR P06213 20/20 1.00
ALK Q9UM73 20/20 1.00
IGF1R P08069 14/20 1.00
AURKA O14965 2/20 0.85
AURKB Q96GD4 2/20 0.85
PLK4 O00444 1/20 0.85
DAPK3 O43293 1/20 0.85
JAK2 O60674 1/20 0.85
MAP4K4 O95819 1/20 0.85
ABL1 P00519 1/20 0.85
NTRK1 P04629 1/20 0.85
PRKCG P05129 1/20 0.85
LCK P06239 1/20 0.85
FYN P06241 1/20 0.85
CSF1R P07333 1/20 0.85
LYN P07948 1/20 0.85
RET P07949 1/20 0.85
MET P08581 1/20 0.85
ROS1 P08922 1/20 0.85
KIT P10721 1/20 0.85

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
SCHEMBL21759430 0.96 INSR (0.92) INSRALKIGF1RAURKAAURKB
SCHEMBL26275691 0.93 INSR (0.88) INSRALKIGF1RAURKAAURKB
SCHEMBL26271852 0.93 INSR (0.87) INSRALKIGF1RAURKAAURKB
SCHEMBL30170709 0.93 INSR (0.86) INSRALKIGF1RAURKAAURKB
SCHEMBL26358559 0.93 INSR (0.88) INSRALKIGF1RAURKAAURKB
SCHEMBL25397352 0.93 INSR (0.86) INSRALKIGF1RAURKAAURKB
SCHEMBL23635199 0.92 INSR (0.87) INSRALKIGF1RAURKAAURKB
SCHEMBL25272952 0.92 INSR (0.87) INSRALKIGF1RAURKAAURKB
Entrectinib SCHEMBL3512601 0.92 INSR (1.00) INSRALKIGF1RAURKAAURKB
SCHEMBL30170811 0.92 INSR (0.85) INSRALKIGF1RAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170356918-A1 MULTIPLEXED IMMUNOHISTOCHEMISTRY ASSAYS FOR DIAGNOSIS AND TREATMENT OF CANCER IGNYTA, INC. (US) 2017-12-14 US claimed
EP-3227686-A1 MULTIPLEXED IMMUNOHISTOCHEMISTRY ASSAYS FOR DIAGNOSIS AND TREATMENT OF CANCER Ignyta, Inc. (US) 2017-10-11 EP claimed
EP-3227276-A1 COMBINATIONS FOR THE TREATMENT OF NEUROBLASTOMA Ignyta, Inc. (US) 2017-10-11 EP claimed
EP-3107541-A1 COMPOUNDS FOR TREATING PATIENTS WITH ROS1 MUTANT CANCER CELLS Ignyta, Inc. (US) 2016-12-28 EP claimed
EP-2176231-B1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2016-10-19 EP claimed
WO-2016089760-A1 COMBINATIONS FOR THE TREATMENT OF NEUROBLASTOMA IGNYTA, INC. (US) 2016-06-09 WO claimed
WO-2016089853-A1 MULTIPLEXED IMMUNOHISTOCHEMISTRY ASSAYS FOR DIAGNOSIS AND TREATMENT OF CANCER IGNYTA, INC. (US) 2016-06-09 WO claimed
US-20150283132-A1 MOLECULES FOR ADMINISTRATION TO ROS1 MUTANT CANCER CELLS IGNYTA, INC. 2015-10-08 US claimed
WO-2015124697-A1 COMPOUNDS FOR TREATING PATIENTS WITH ROS1 MUTANT CANCER CELLS IGNYTA, INC. (US) 2015-08-27 WO claimed
US-9102662-B2 Substituted indazole derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-08-11 US claimed
US-20150057292-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-02-26 US claimed
US-8299057-B2 Substituted indazole derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-10-30 US claimed
US-20100292207-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-11-18 US claimed
EP-2176231-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2010-04-21 EP claimed
WO-2009013126-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-01-29 WO claimed
EP-4736882-A2 TROPOMYOSIN RECEPTOR KINASE (TRK) DEGRADATION COMPOUNDS AND METHODS OF USE Cullgen (Shanghai), Inc. (CN) 2026-05-06 EP disclosed
EP-3841098-B1 TROPOMYOSIN RECEPTOR KINASE (TRK) DEGRADATION COMPOUNDS AND METHODS OF USE CULLGEN SHANGHAI INC (CN) 2026-01-14 EP disclosed
EP-2176231-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2010-04-21 EP disclosed
WO-2009013126-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-01-29 WO disclosed
WO-2009013126-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-01-29 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 (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-20100292207-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS MAP3K19, MAP3K3, MAP3K5 INSR 387/4885ALK 401/4885IGF1R 188/4885
US-20150283132-A1 MOLECULES FOR ADMINISTRATION TO ROS1 MUTANT CANCER CELLS ROS1, KRAS, NOX1 INSR 303/4885ALK 337/4885IGF1R 72/4885
US-20170356918-A1 MULTIPLEXED IMMUNOHISTOCHEMISTRY ASSAYS FOR DIAGNOSIS AND TREATMENT OF CANCER TP53, BRCA1, MKI67 INSR 3857/4885ALK 277/4885IGF1R 541/4885
US-20150057292-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS MAP3K19, ABL1, MAP3K20 INSR 433/4885ALK 397/4885IGF1R 212/4885

“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.