SCHEMBL24599799

SCHEMBL24599799

CCCOc1ncccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
NPC1 O15118 4/20 0.41
RAB9A P51151 3/20 0.41
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
TSHR P16473 1/20 0.39
DRD1 P21728 2/20 0.38
SSTR4 P31391 1/20 0.38
CSNK2A1 P68400 2/20 0.38
PDE1A P54750 1/20 0.37
PDE1B Q01064 1/20 0.37
PDE1C Q14123 1/20 0.37
NFE2L2 Q16236 1/20 0.37
GRM5 P41594 1/20 0.37

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
SCHEMBL8983543 0.91 CYP2D6 (0.44) GAANPC1RAB9AMAPK1SMN1; SMN2
SCHEMBL29436326 0.91 CYP2D6 (0.44) GAANPC1RAB9AMAPK1SMN1; SMN2
SCHEMBL7151486 0.89 FAAH (0.43) GAANPC1RAB9AMAPK1L3MBTL1
SCHEMBL9428914 0.87 FAAH (0.45) GAAMAPTALDH1A1KMT2ATSHR
SCHEMBL11812262 0.84 GAA (0.51) GAANPC1RAB9AMAPK1SMN1; SMN2
SCHEMBL27634546 0.78 GRM5 (0.48) NPC1RAB9AMAPK1SMN1; SMN2MAPT
SCHEMBL129523 0.78 PDE1A (0.43) GAANPC1RAB9AMAPK1SMN1; SMN2
SCHEMBL11755561 0.78 DPP4 (0.41) GAANPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL1936652 0.77 CYP1A2 (0.43) GAANPC1RAB9AMAPK1SMN1; SMN2
SCHEMBL12754891 0.77 KDM4E (0.45) GAANPC1RAB9AMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213039-A1 PYRIDINIUM SALTS AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2022-07-07 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-20220213039-A1 PYRIDINIUM SALTS AND PEST CONTROL AGENT ZYX, PNPO, PRDX1 GAA 4386/4885NPC1 4521/4885RAB9A 2987/4885

“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.