SCHEMBL360064

SCHEMBL360064

CCC(C)Cc1c[nH]c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.69
HTR1A P08908 2/20 0.68
HTR6 P50406 2/20 0.68
ADRB1 P08588 1/20 0.68
ADRA2A P08913 1/20 0.68
SLC6A2 P23975 1/20 0.68
HTR1D P28221 1/20 0.68
HTR1B P28222 1/20 0.68
HTR2C P28335 1/20 0.68
HTR1E P28566 1/20 0.68
SLC6A4 P31645 1/20 0.68
HTR7 P34969 1/20 0.68
HTR2B P41595 1/20 0.68
SLC6A3 Q01959 1/20 0.68
MAPT P10636 4/20 0.60
KDM4E B2RXH2 4/20 0.60
POLB P06746 2/20 0.60
APAF1 O14727 1/20 0.60
RECQL P46063 1/20 0.60
L3MBTL1 Q9Y468 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
SCHEMBL14473032 1.00 HTR2A (0.69) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL8246556 1.00 HTR2A (0.69) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL22803428 1.00 HTR2A (0.69) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL14472913 0.88 HTR2A (0.66) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL15344197 0.88 HTR2A (0.66) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL357990 0.85 HTR2A (0.66) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL22851547 0.85 HTR2A (0.71) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL14665073 0.85 HTR2A (0.67) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL13947623 0.85 HTR2A (0.71) HTR2AHTR1AHTR6ADRB1ADRA2A
SCHEMBL1911320 0.85 HTR2A (0.66) HTR2AHTR1AHTR6ADRB1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11578101-B2 Proteasome inhibitors UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2023-02-14 US disclosed
US-11357873-B2 Chiral cyclen compounds and their uses THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2022-06-14 US disclosed
US-20220168436-A1 ANTIBODY DRUG CONJUGATES PHARMA MAR SA (ES) 2022-06-02 US disclosed
WO-2021217019-A1 RAS INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-10-28 WO disclosed
US-20210283278-A1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2021-09-16 US disclosed
WO-2021044420-A1 LIQUID COMPOSITIONS COMPRISING A LEVODOPA AMINO ACID CONJUGATE AND USES THEREOF NEURODERM, LTD. (IL) 2021-03-11 WO disclosed
WO-2021011481-A1 ANTI-INFLAMMATORY FACTORS THE GENERAL HOSPITAL CORPORATION (US) 2021-01-21 WO disclosed
US-20200390895-A1 UNIVERSAL ABT COMPOUNDS AND USES THEREOF KLEO PHARMACEUTICALS, INC. 2020-12-17 US disclosed
EP-2928902-B1 CONJUGATE COMPOUNDS VICTORIA LINK LTD (NZ) 2019-07-17 EP disclosed
US-10280229-B2 Linkers and their application towards ADC MEDSHINE DISCOVERY INC. (CN) 2019-05-07 US disclosed
US-20170020837-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-01-26 US disclosed
US-8633160-B2 Small molecule inhibitors of PDZ interactions NONO INC. (CA) 2014-01-21 US disclosed
US-20120251559-A1 Treatment of B-Cell Cancers With Anti-CD70 Antibody-Drug Conjugates SEATTLE GENETICS, INC. (US) 2012-10-04 US disclosed
EP-2013211-B1 PURINE DERIVATIVES FOR USE AS ADENOSIN A2A RECEPTOR AGONISTS NOVARTIS AG (CH) 2012-03-14 EP disclosed
US-20100183636-A1 ANTI-CD70 ANTIBODY-DRUG CONJUGATES AND THEIR USE FOR THE TREATMENT OF CANCER AND IMMUNE DISORDERS SEATTLE GENETICS, INC. (US) 2010-07-22 US disclosed
EP-0722321-A4 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS UNIV FLORIDA STATE (US) 1998-04-15 EP disclosed
EP-0722321-A1 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1996-07-24 EP disclosed
WO-1995009620-A1 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1995-04-13 WO disclosed
EP-0547178-A4 NOVEL CHOLECYSTOKININ ANTAGONISTS, THEIR PREPARATION AND THERAPEUTIC USE WARNER LAMBERT CO (US) 1994-07-06 EP disclosed
EP-0547178-A1 NOVEL CHOLECYSTOKININ ANTAGONISTS, THEIR PREPARATION AND THERAPEUTIC USE WARNER-LAMBERT COMPANY (US) 1993-06-23 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 (9 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-11578101-B2 Proteasome inhibitors PSMG3, PSME1, PSMB1 HTR2A 4346/4885HTR1A 4324/4885HTR6 4052/4885
US-20220168436-A1 ANTIBODY DRUG CONJUGATES CD79B, OGFR, CD2 HTR2A 3395/4885HTR1A 1769/4885HTR6 3705/4885
US-20100183636-A1 ANTI-CD70 ANTIBODY-DRUG CONJUGATES AND THEIR USE FOR THE TREATMENT OF CANCER AND IMMUNE DISORDERS CD74, CD63, CD2 HTR2A 3514/4885HTR1A 4009/4885HTR6 2948/4885
US-11357873-B2 Chiral cyclen compounds and their uses DCTN3, DCTN1, CDK3 HTR2A 1326/4885HTR1A 1718/4885HTR6 4667/4885
US-20210283278-A1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES DCTN3, DCTN1, CDK3 HTR2A 1326/4885HTR1A 1718/4885HTR6 4667/4885
US-20170020837-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE FH, FPGS, APC HTR2A 3011/4885HTR1A 2509/4885HTR6 2098/4885
US-20120251559-A1 Treatment of B-Cell Cancers With Anti-CD70 Antibody-Drug Conjugates CD22, CD79B, CD74 HTR2A 3972/4885HTR1A 4466/4885HTR6 3668/4885
US-10280229-B2 Linkers and their application towards ADC DNPEP, DPP7, DPP3 HTR2A 4571/4885HTR1A 4462/4885HTR6 4137/4885
US-20200390895-A1 UNIVERSAL ABT COMPOUNDS AND USES THEREOF CD47, MCL1, BCL9 HTR2A 4204/4885HTR1A 4377/4885HTR6 3590/4885

“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.