SCHEMBL22134643

SCHEMBL22134643

COc1ccccc1C(=O)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.55
NPC1 O15118 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
STAT3 P40763 1/20 0.53
GAA P10253 3/20 0.52
RAB9A P51151 3/20 0.51
KCNK3 O14649 2/20 0.51
KCNK9 Q9NPC2 2/20 0.51
RXFP1 Q9HBX9 2/20 0.51
HPGD P15428 3/20 0.49
MAPT P10636 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TP53 P04637 1/20 0.49
GLA P06280 1/20 0.49
LMNA P02545 1/20 0.49
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL22134630 0.84 KCNK3 (0.55) SMN1; SMN2KCNK3KCNK9RXFP1MAPT
SCHEMBL2169790 0.81 CTSD (0.62) CTSDNPC1SMN1; SMN2STAT3GAA
SCHEMBL30744822 0.81 CTSD (0.62) CTSDNPC1SMN1; SMN2STAT3GAA
SCHEMBL29097533 0.80 CTSD (0.60) CTSDNPC1SMN1; SMN2STAT3GAA
SCHEMBL7973351 0.78 CTSD (0.63) CTSDNPC1SMN1; SMN2STAT3GAA
SCHEMBL22503203 0.78 ALDH1A1 (0.49) SMN1; SMN2GAAHPGDMAPTALDH1A1
SCHEMBL26163054 0.78 HPGD (0.61) NPC1SMN1; SMN2GAARAB9AHPGD
SCHEMBL16244081 0.77 KDM4E (0.62) CTSDNPC1SMN1; SMN2STAT3GAA
SCHEMBL23014667 0.76 PTGS1 (0.51) NPC1SMN1; SMN2GAARAB9AHPGD
SCHEMBL18921062 0.76 SMN1; SMN2 (0.51) NPC1SMN1; SMN2GAARAB9ARXFP1

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-20230219919-A1 LITHIUM EXTRACTION WITH CROWN ETHERS ORCA HOLDINGS, LLC 2023-07-13 US disclosed
US-20230219919-A1 LITHIUM EXTRACTION WITH CROWN ETHERS ORCA HOLDINGS, LLC 2023-07-13 US disclosed
WO-2020131964-A1 LITHIUM EXTRACTION WITH CROWN ETHERS 6th Wave Innovations Corp. (US) 2020-06-25 WO 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-20230219919-A1 LITHIUM EXTRACTION WITH CROWN ETHERS LCLAT1, LCT, IGF2R CTSD 2571/4885NPC1 583/4885SMN1; SMN2 4559/4885

“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.