SCHEMBL25493045

SCHEMBL25493045

CC(C)OCCCn1cnc(Cl)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
NPSR1 Q6W5P4 3/20 0.49
PKM P14618 1/20 0.37
POLB P06746 2/20 0.35
ALDH1A1 P00352 7/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
KDM4E B2RXH2 5/20 0.33
GLA P06280 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
PLK1 P53350 1/20 0.32
CRHR1 P34998 1/20 0.32
GAA P10253 3/20 0.32
MAPK1 P28482 1/20 0.31
CASP3 P42574 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
SCHEMBL23657286 0.81 MAPT (0.58) MAPTNPSR1PKMPOLBALDH1A1
SCHEMBL25497888 0.79 MAPT (0.51) MAPTNPSR1PKMPOLBALDH1A1
SCHEMBL25493037 0.75 FDPS (0.36) MAPTPOLBALDH1A1CYP1A2CYP2C9
SCHEMBL848265 0.70 POLB (0.44) MAPTNPSR1PKMPOLBCYP1A2
SCHEMBL25067227 0.69 ALDH1A1 (0.59) POLBALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL9265326 0.68
Hydrochloric Acid SCHEMBL6927175 0.68 TSHR (0.33) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL8446110 0.66 NPSR1 (0.47) MAPTNPSR1PKMPOLBALDH1A1
SCHEMBL6929098 0.66 CYP11B1 (0.38) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL5983173 0.65 CRHR1 (0.34) MAPTNPSR1POLBALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF PIMEDBIO, INC. (KR) 2023-05-11 US disclosed
US-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF PIMEDBIO, INC. (KR) 2023-05-11 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-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF TYR, TYRO3, TH MAPT 3176/4885NPSR1 698/4885PKM 1222/4885

“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.