SCHEMBL733436

SCHEMBL733436

CN1CCN(c2ccc(CCl)nc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
HTR3A P46098 1/20 0.45
GAA P10253 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
GLA P06280 1/20 0.45
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
ADRA2C P18825 2/20 0.44
GFER P55789 1/20 0.44
PTK2B Q14289 1/20 0.44
ESR2 Q92731 1/20 0.44
PRCP P42785 1/20 0.41
CCNK O75909 3/20 0.41
CCND3 P30281 3/20 0.41
CDK9 P50750 3/20 0.41
CDK6 Q00534 3/20 0.41
CHKA P35790 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL19251586 0.85 KDM4E (0.49) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL29493254 0.83 MAPT (0.49) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL28943557 0.83 MAPT (0.49) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL27306266 0.83 MAPT (0.45) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL30922297 0.83 CHKA (0.51) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL21414319 0.82 MAPT (0.44) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL27788009 0.78 CHEK1 (0.45) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL1321991 0.77 AKR1C3 (0.54) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL23916695 0.77 HRH3 (0.42) MAPTHTR3AGAAKMT2AMEN1
SCHEMBL82236 0.75 MAPT (0.50) MAPTHTR3AGAAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284275-B2 Inhibitor compounds and cancer treatment methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2016-03-15 US disclosed
US-8822475-B2 Compounds and method for treatment of cancer CRITICAL OUTCOME TECHNOLOGIES, INC. (CA) 2014-09-02 US disclosed
US-8822475-B2 Compounds and method for treatment of cancer CRITICAL OUTCOME TECHNOLOGIES, INC. (CA) 2014-09-02 US disclosed
US-20140072555-A1 Inhibitor Compounds and Cancer Treatment Methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2014-03-13 US disclosed
US-20140072555-A1 Inhibitor Compounds and Cancer Treatment Methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2014-03-13 US disclosed
US-8580792-B2 Inhibitor compounds and cancer treatment methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2013-11-12 US disclosed
US-8580792-B2 Inhibitor compounds and cancer treatment methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2013-11-12 US disclosed
US-20130165449-A1 Compounds and Method for Treatment of Cancer CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2013-06-27 US disclosed
US-20130165449-A1 Compounds and Method for Treatment of Cancer CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2013-06-27 US disclosed
US-8420643-B2 Compounds and method for treatment of cancer CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2013-04-16 US disclosed
US-20120077820-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2012-03-29 US disclosed
US-8138191-B2 Inhibitor compounds and cancer treatment methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2012-03-20 US disclosed
US-8138191-B2 Inhibitor compounds and cancer treatment methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2012-03-20 US disclosed
US-20110281887-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2011-11-17 US disclosed
US-20110281887-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2011-11-17 US disclosed
US-8034815-B2 Imidazol-1-yl-(4-pyridin-2-yl-piperazin-1-yl)-methanethione; Critical Outcome Technologies' Iead compound (COTI); kinase inhibitor; anticarcinogenic agent; especially small cell lung cancer; cervical, ovarian, skin, prostate, breast, colorectal, head, neck, or kidney cancer, sarcoma, leukemia CRITICAL OUTCOME TECHNOLOGIES, INC. (CA) 2011-10-11 US disclosed
US-20100015140-A1 Inhibitor Compounds and Cancer Treatment Methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2010-01-21 US disclosed
US-20100015140-A1 Inhibitor Compounds and Cancer Treatment Methods CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2010-01-21 US disclosed
US-20080171744-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER 6441513 CANADA INC. (CA) 2008-07-17 US disclosed
US-20080171744-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER 6441513 CANADA INC. (CA) 2008-07-17 US 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-20130165449-A1 Compounds and Method for Treatment of Cancer TBCA, SLC6A6, SLC5A1 MAPT 39/4885HTR3A 1634/4885GAA 1943/4885
US-20080171744-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER SLC6A6, SLCO1B3, SLC5A1 MAPT 30/4885HTR3A 1661/4885GAA 2363/4885
US-20110281887-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER TBCA, SLC6A6, SLC5A1 MAPT 39/4885HTR3A 1634/4885GAA 1943/4885
US-20120077820-A1 COMPOUNDS AND METHOD FOR TREATMENT OF CANCER TBCA, SLC6A6, SLC5A1 MAPT 39/4885HTR3A 1634/4885GAA 1943/4885
US-20100015140-A1 Inhibitor Compounds and Cancer Treatment Methods MTOR, RICTOR, RPTOR MAPT 3309/4885HTR3A 4550/4885GAA 3414/4885
US-20140072555-A1 Inhibitor Compounds and Cancer Treatment Methods MTOR, RICTOR, RPTOR MAPT 3309/4885HTR3A 4550/4885GAA 3414/4885

“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.