SCHEMBL5401475

SCHEMBL5401475

CCCc1cc(F)c(O)c(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
PTGS2 P35354 4/20 0.34
CYP3A4 P08684 2/20 0.34
PTPN1 P18031 2/20 0.34
PTGS1 P23219 1/20 0.34
MEP1B Q16820 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL1523705 0.86 CNR1 (0.43) NPSR1CNR1CNR2PTGS2CYP3A4
SCHEMBL542182 0.86 CYP3A4 (0.46) CYP2D6CYP2C9NPSR1CNR1CNR2
SCHEMBL27613126 0.78 PTGS2 (0.43) NPSR1CNR1CNR2PTGS2CYP3A4
Bicarbonate SCHEMBL11439022 0.78 PTPN1 (0.47) CYP2C9CNR1CNR2CYP3A4PTPN1
SCHEMBL29171861 0.78 NPSR1 (0.38) CYP2D6CYP2C9NPSR1CYP1A2CYP2C19
SCHEMBL31571441 0.77 CNR1 (0.34) CYP2D6CYP2C9NPSR1CYP1A2CYP2C19
SCHEMBL13323514 0.77 CNR1 (0.37) NPSR1CNR1CNR2PTGS2CYP3A4
SCHEMBL5182611 0.77 CNR1 (0.37) NPSR1CNR1CNR2PTGS2CYP3A4
SCHEMBL29171973 0.77 NPSR1 (0.40) CYP2D6CYP2C9NPSR1CYP1A2CYP2C19
SCHEMBL29171938 0.75 CYP1A2 (0.33) CYP2D6CYP2C9NPSR1CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4585588-A1 BENZIMIDAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Suzhou Pharmavan Co., Ltd. (CN) 2025-07-16 EP disclosed
CN-117720472-A Benzimidazole compound, and preparation method and application thereof 苏州沪云新药研发股份有限公司 2024-03-19 CN disclosed
WO-2024051354-A1 BENZIMIDAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 苏州沪云新药研发股份有限公司 2024-03-14 WO disclosed
US-7255900-B2 Fluorinated heterocycles and their use in liquid-crystal mixtures MERCK PATENT GMBH (DE) 2007-08-14 US disclosed
US-20050258399-A1 Fluorinated heterocycles and their use in liquid-crystal mixtures MERCK PATENT GMBH (DE) 2005-11-24 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 (1 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-20050258399-A1 Fluorinated heterocycles and their use in liquid-crystal mixtures CHRM1, AFF1, H1-0 CYP2D6 1133/4885CYP2C9 1649/4885NPSR1 845/4885

“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.