SCHEMBL365070

SCHEMBL365070

N#Cc1cc(CBr)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 1/20 0.44
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
ACACB O00763 1/20 0.39
TRPV4 Q9HBA0 1/20 0.38
MAOB P27338 3/20 0.38
MAOA P21397 2/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
SLC22A12 Q96S37 3/20 0.36
IDO1 P14902 2/20 0.36
PYCR1 P32322 1/20 0.35
GRM4 Q14833 1/20 0.35
VNN1 O95497 1/20 0.35
PGK1 P00558 1/20 0.34
BCL2A1 Q16548 1/20 0.34
SNCA P37840 1/20 0.33
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32

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
SCHEMBL29413225 1.00 VCAM1 (0.44) VCAM1CYP4F2CYP4A11ACACBTRPV4
SCHEMBL2569992 0.84 TRPV4 (0.52) TRPV4MAOBMAOAMRGPRX4IDO1
SCHEMBL5066101 0.81 MAOB (0.49) TRPV4MAOBMAOASNCA
SCHEMBL20489787 0.80 LOXL2 (0.47) VCAM1ACACBTRPV4MAOBMAOA
SCHEMBL16954518 0.80 VCAM1 (0.49) VCAM1ACACBTRPV4MAOBMAOA
SCHEMBL23550068 0.80 VCAM1 (0.44) VCAM1ACACBTRPV4MAOBMAOA
SCHEMBL12188756 0.80 CYP2A6 (0.47) VCAM1ACACBTRPV4MAOBMAOA
SCHEMBL18006944 0.79 PYCR1 (0.46) VCAM1ACACBPYCR1
SCHEMBL8364091 0.78 SNCA (0.41) TRPV4MAOBMAOASNCA
SCHEMBL15716128 0.78 MAOB (0.39) TRPV4MAOBMAOAPYCR1GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12473314-B2 Phospholipid compounds and uses thereof GILEAD SCIENCES, INC. (US) 2025-11-18 US disclosed
EP-4537828-A2 PHOSPHOLIPID COMPOUNDS AND USES THEREOF Gilead Sciences, Inc. (US) 2025-04-16 EP disclosed
EP-4200301-B1 PHOSPHOLIPID COMPOUNDS AND USES THEREOF GILEAD SCIENCES INC (US) 2025-02-26 EP disclosed
US-12187728-B2 Caffeine inhibitors of MTHFD2 and uses thereof RAZE THERAPEUTICS, INC. (US) 2025-01-07 US disclosed
US-12030904-B2 Phospholipid compounds and uses thereof GILEAD SCIENCES, INC. (US) 2024-07-09 US disclosed
US-20240025932-A1 PHOSPHOLIPID COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. 2024-01-25 US disclosed
US-20230416202-A1 Small Molecule Compounds and Compositions TELO THERAPEUTICS, INC. 2023-12-28 US disclosed
US-11773122-B2 Phospholipid compounds and uses thereof GILEAD SCIENCES. INC. (US) 2023-10-03 US disclosed
EP-4247374-A1 SMALL MOLECULE COMPOUNDS AND COMPOSITIONS Telo Therapeutics, Inc. (US) 2023-09-27 EP disclosed
CN-116710431-A Small molecule compounds and compositions 泰洛治疗公司 2023-09-05 CN disclosed
WO-2010093845-A1 TRIAZOLE AND IMIDAZOLE DERIVATIVES FOR USE AS TGR5 AGONISTS IN THE TREATMENT OF DIABETES AND OBESITY EXELIXIS, INC. (US) 2010-08-19 WO disclosed
US-20100016315-A1 Iminopyridine Derivative and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-21 US disclosed
EP-2077262-A1 IMINOPYRIDINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2009-07-08 EP disclosed
US-20090047249-A1 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. 2009-02-19 US disclosed
WO-2009005687-A1 PURINE DERIVATIVES AND THEIR USE AS MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES, INC. (US) 2009-01-08 WO disclosed
US-4950673-A 5-amino or substituted amino 1,2,3-triazoles MERCK & CO., INC. (US) 1990-08-21 US disclosed
EP-0151528-B1 5-(AMINO OR SUBSTITUTED AMINO)-1,2,3-TRIAZOLES MERCK & CO. INC. (US) 1990-07-04 EP disclosed
US-4816469-A 5-Amino or substituted amino 1,2,3-triazoles MERCK & CO., INC. (US) 1989-03-28 US disclosed
US-4721791-A 5-amino or substituted amino 1,2,3-triazoles MERCK & CO., INC. (US) 1988-01-26 US disclosed
EP-0151528-A2 5-(Amino or substituted amino)-1,2,3-triazoles MERCK & CO. INC. (US) 1985-08-14 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 (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-12187728-B2 Caffeine inhibitors of MTHFD2 and uses thereof MTHFD2, MTHFD1, NUDT15 VCAM1 4087/4885CYP4F2 33/4885CYP4A11 1190/4885
US-20100016315-A1 Iminopyridine Derivative and Use Thereof ADRA1D, ADRB1, ADRB2 VCAM1 459/4885CYP4F2 3209/4885CYP4A11 1829/4885
US-12030904-B2 Phospholipid compounds and uses thereof PHOSPHO1, SGMS2, SGMS1 VCAM1 1281/4885CYP4F2 2279/4885CYP4A11 2224/4885
US-20230416202-A1 Small Molecule Compounds and Compositions TERT, TP53, EP300 VCAM1 4055/4885CYP4F2 4563/4885CYP4A11 3707/4885
US-20240025932-A1 PHOSPHOLIPID COMPOUNDS AND USES THEREOF PHOSPHO1, SGMS2, SGMS1 VCAM1 1281/4885CYP4F2 2279/4885CYP4A11 2224/4885
US-20090047249-A1 Modulators of toll-like receptor 7 TLR7, TLR6, TLR3 VCAM1 709/4885CYP4F2 3150/4885CYP4A11 3181/4885
US-11773122-B2 Phospholipid compounds and uses thereof PHOSPHO1, SGMS2, SGMS1 VCAM1 1281/4885CYP4F2 2279/4885CYP4A11 2224/4885
US-12473314-B2 Phospholipid compounds and uses thereof PHOSPHO1, SGMS2, SGMS1 VCAM1 1281/4885CYP4F2 2279/4885CYP4A11 2224/4885

“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.