SCHEMBL2389301

SCHEMBL2389301

CC(Br)c1ccc(I)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.39
ACACB O00763 1/20 0.37
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
APEX1 P27695 1/20 0.34
PMP22 Q01453 1/20 0.34
HDAC8 Q9BY41 1/20 0.32
CNR1 P21554 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
ESR1 P03372 1/20 0.31
PDCD1 Q15116 1/20 0.31
ESR2 Q92731 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31

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
SCHEMBL1415320 0.85 ESR1 (0.38) CYP1A2CYP2D6ESR1PDCD1ESR2
SCHEMBL18243011 0.78 ACACB (0.41) GSK3BACACBCYP1A2CYP2D6APEX1
SCHEMBL2556379 0.77 GSK3B (0.42) GSK3BACACBHDAC8CNR1CA1
SCHEMBL10714 0.77 TYR (0.46) ACACBCYP1A2CYP2D6
SCHEMBL672518 0.77 ESR1 (0.52) GSK3BACACBCYP1A2CYP2D6APEX1
SCHEMBL5695686 0.77 TYR (0.46) CYP2D6
SCHEMBL9510147 0.77 PTGS2 (0.39) CYP2D6ESR1PDCD1ESR2CD274
SCHEMBL31489555 0.74 ACHE (0.47) CA1CA2
SCHEMBL810756 0.74 CYP2A6 (0.47) CYP1A2
SCHEMBL4434585 0.74 ACHE (0.47) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353829-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF TEMPEST THERAPEUTICS INC (US) 2025-11-20 US disclosed
US-12215093-B2 Bicyclic carboxamides and methods of use thereof TEMPEST THERAPEUTICS, INC. (US) 2025-02-04 US disclosed
EP-3781550-B1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF TEMPEST THERAPEUTICS INC (US) 2024-10-30 EP disclosed
US-20240150316-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF TEMPEST THERAPEUTICS, INC. 2024-05-09 US disclosed
CN-112313208-B Bicyclic carboxamides and methods of use thereof 泰普斯特医疗公司 2024-04-19 CN disclosed
US-20230365556-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE PLIANT THERAPEUTICS, INC. (US) 2023-11-16 US disclosed
US-20230365556-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE PLIANT THERAPEUTICS, INC. (US) 2023-11-16 US disclosed
US-20230365556-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE PLIANT THERAPEUTICS, INC. (US) 2023-11-16 US disclosed
US-11795156-B2 Bicyclic carboxamides and methods of use thereof TEMPEST THERAPEUTICS, INC. (US) 2023-10-24 US disclosed
US-11795156-B2 Bicyclic carboxamides and methods of use thereof TEMPEST THERAPEUTICS, INC. (US) 2023-10-24 US disclosed
CN-1902198-A Imidazo [4, 5-c ] pyridine compounds and methods of antiviral treatment K U LEUVEN RES & DEV GERHARD P (BE) 2007-01-24 CN disclosed
US-20060194857-A1 Novel heteroaryl derivative DAINIPPON SUMITOMO PHARMA CO. LTD. (JP) 2006-08-31 US disclosed
US-20060142207-A1 Compositions and methods for treating cancer THRESHOLD PHARMACEUTICALS, INC. (US) 2006-06-29 US disclosed
EP-1647546-A1 NOVEL HETEROARYL DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-04-19 EP disclosed
US-7001888-B2 Compositions and methods for treating cancer THRESHOLD PHARMACEUTICALS, INC. (US) 2006-02-21 US disclosed
CN-1678613-A Hetereoaryl nitrile derivatives NOVARTIS AG (CH) 2005-10-05 CN disclosed
US-20040029815-A1 Compositions and methods for treating cancer THRESHOLD PHARMACEUTICALS, INC. 2004-02-12 US disclosed
WO-2003082301-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THRESHOLD PHARMACEUTICALS, INC. (US) 2003-10-09 WO disclosed
US-4633026-A DEHYDROHALOGENATION OF RING-HALOGENATED ALPHA- OR BETA-BROMOETHYL BENZENES WITH STRONG BASE, POLYOXYETHYLENE GLYCOL CATALYST, AMINE POLYMERIZATION INHIBITOR ETHYL CORPORATION (US) 1986-12-30 US disclosed
US-4185992-A Imidazole derivatives MAY & BAKER LIMITED (GB) 1980-01-29 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 (8 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-11795156-B2 Bicyclic carboxamides and methods of use thereof PTGER4, PTGER2, CNR2 GSK3B 3865/4885ACACB 933/4885CYP1A2 682/4885
US-20040029815-A1 Compositions and methods for treating cancer SLC2A2, SLC2A1, SLC2A3 GSK3B 2924/4885ACACB 422/4885CYP1A2 4469/4885
US-20060194857-A1 Novel heteroaryl derivative NR0B1, UGT1A10, NR0B2 GSK3B 1629/4885ACACB 1840/4885CYP1A2 30/4885
US-20240150316-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF PTGER4, PTGER2, CNR2 GSK3B 3865/4885ACACB 933/4885CYP1A2 682/4885
US-20250353829-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF PTGER4, PTGER2, CNR2 GSK3B 3865/4885ACACB 933/4885CYP1A2 682/4885
US-20060142207-A1 Compositions and methods for treating cancer SLC2A2, SLC2A1, SLC2A3 GSK3B 2924/4885ACACB 422/4885CYP1A2 4469/4885
US-20230365556-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE ITGA1, ITGB1, ITGAL GSK3B 1619/4885ACACB 1631/4885CYP1A2 3869/4885
US-12215093-B2 Bicyclic carboxamides and methods of use thereof PTGER4, PTGER2, CNR2 GSK3B 3865/4885ACACB 933/4885CYP1A2 682/4885

“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.