SCHEMBL25844879

SCHEMBL25844879

ClCc1cc(Cl)cc2c1OCCO2

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 2/20 0.33
MAOB P27338 2/20 0.33
MAP3K14 Q99558 2/20 0.32
MTNR1A P48039 3/20 0.31
MEN1 O00255 1/20 0.31
PLA2G1B P04054 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
HTR1A P08908 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL25844870 0.86 MAOB (0.34) MAOBPOLBCYP3A4
SCHEMBL13186975 0.83 MTNR1A (0.36) LARS1MAOBMAP3K14MTNR1AMEN1
SCHEMBL9921215 0.81 CYP3A4 (0.37) LARS1MAOBMAP3K14MTNR1AMEN1
SCHEMBL1054578 0.79 ERBB2 (0.36) LARS1MTNR1AHTR1ACYP1A2CYP3A4
SCHEMBL9917332 0.79 MTNR1A (0.31) LARS1MAOBMAP3K14MTNR1A
SCHEMBL32689793 0.76 GPR17 (0.41) MTNR1AMEN1MAPTKMT2AHSD17B10
SCHEMBL13534197 0.72 MAP3K14 (0.42) LARS1MAOBMAP3K14MEN1GAA
SCHEMBL31276593 0.72 MAP3K14 (0.33) LARS1MAOBMAP3K14HTR1A
SCHEMBL4167422 0.72 MAPT (0.39) LARS1MAP3K14GAAMAPTHTR1A
SCHEMBL263819 0.72 MEN1 (0.41) LARS1MAOBMAP3K14MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339919-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICAL APPLICATION THEREOF AB Pharma Ltd. (CN) 2023-10-26 US disclosed
US-20230339919-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICAL APPLICATION THEREOF AB Pharma Ltd. (CN) 2023-10-26 US disclosed
EP-4212528-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUND AND MEDICAL APPLICATION THEREOF AB Pharma Ltd. (CN) 2023-07-19 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 (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-20230339919-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICAL APPLICATION THEREOF GPR55, GPR65, GPR4 LARS1 2967/4885MAOB 370/4885MAP3K14 3632/4885

“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.