SCHEMBL9119581

SCHEMBL9119581

CCOC(=O)c1ccc(Br)c(N)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.59
LMNA P02545 1/20 0.59
CYP3A4 P08684 1/20 0.59
MAOA P21397 1/20 0.59
CA12 O43570 3/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA7 P43166 3/20 0.56
CA9 Q16790 3/20 0.56
CA14 Q9ULX7 3/20 0.56
PTGER4 P35408 3/20 0.55
ALOX15 P16050 1/20 0.52
ESR1 P03372 2/20 0.51
ESR2 Q92731 1/20 0.51
HSD17B2 P37059 1/20 0.50
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PRMT1 Q99873 1/20 0.47
HCRTR1 O43613 1/20 0.47
STS P08842 1/20 0.46

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
SCHEMBL3523526 0.87 LMNA (0.64) CYP1A2LMNACYP3A4MAOACA12
Hydrochloric Acid SCHEMBL3626529 0.85 LMNA (0.62) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL30582428 0.84 LMNA (0.65) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL940578 0.84 LMNA (0.65) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL22468902 0.84 CA12 (0.61) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL31700926 0.83 CA12 (0.59) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL137202 0.83 CA12 (0.59) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL868290 0.83 LMNA (0.62) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL1927097 0.83 LMNA (0.62) CYP1A2LMNACYP3A4MAOACA12
SCHEMBL10487727 0.81 CA12 (0.57) CYP1A2LMNACYP3A4MAOACA12

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118146176-B GPR133/ADGRD1 agonist, preparation method and application thereof 山东大学 2024-11-15 CN disclosed
CN-118146176-A GPR133/ADGRD1 agonist, preparation method and application thereof 山东大学 2024-06-07 CN disclosed
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 US disclosed
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 US disclosed
US-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2023-10-26 US disclosed
WO-2022081925-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed
US-5436259-A Angiotensive II antagonist as hypotensive agents MERCK & CO., INC. (US) 1995-07-25 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 (2 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-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 IKZF1, IKZF3, IKZF2 CYP1A2 3530/4885LMNA 3011/4885CYP3A4 2637/4885
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY NFATC1, CTSS, MMP12 CYP1A2 2070/4885LMNA 3978/4885CYP3A4 2566/4885

“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.