SCHEMBL6434825

SCHEMBL6434825

Fc1cccc(NC(=S)Nc2cccc(C(F)(F)F)c2)c1F

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.64
MAPT P10636 8/20 0.64
NPSR1 Q6W5P4 6/20 0.64
GAA P10253 5/20 0.64
TDP1 Q9NUW8 3/20 0.64
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
CYP1A2 P05177 2/20 0.62
CYP3A4 P08684 2/20 0.62
CYP2D6 P10635 2/20 0.62
CYP2C19 P33261 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
IDO1 P14902 1/20 0.61
POLB P06746 1/20 0.61
CYP2C9 P11712 1/20 0.61
XBP1 P17861 1/20 0.61
L3MBTL1 Q9Y468 4/20 0.60
KDM4E B2RXH2 2/20 0.60
LMNA P02545 5/20 0.60
HTT P42858 1/20 0.60

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
SCHEMBL16322745 0.90 ALDH1A1 (0.70) ALDH1A1MAPTNPSR1GAATDP1
SCHEMBL7175227 0.85 MAPT (0.86) ALDH1A1MAPTNPSR1GAATDP1
SCHEMBL6434716 0.83 KDR (0.67) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL7596527 0.83 ALDH1A1 (0.68) ALDH1A1MAPTNPSR1GAATDP1
SCHEMBL22567749 0.81 MAPT (0.78) ALDH1A1MAPTNPSR1GAATDP1
SCHEMBL22567938 0.81 MAPT (0.78) ALDH1A1MAPTNPSR1GAATDP1
SCHEMBL28033909 0.80 ALDH1A1 (0.51) ALDH1A1MAPTNPSR1GAAMEN1
SCHEMBL16766898 0.80 ALDH1A1 (0.67) ALDH1A1MAPTNPSR1GAATDP1
SCHEMBL8368225 0.79 MAPT (0.66) ALDH1A1MAPTNPSR1GAATDP1
SCHEMBL22024982 0.78 SMN1; SMN2 (0.75) ALDH1A1MAPTNPSR1GAATDP1

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-20050080112-A1 Compounds for use in disorders associated with mast cell or basophil acitvity POSEIDON PHARMACEUTICALS A/S (DK) 2005-04-14 US claimed
US-20050080112-A1 Compounds for use in disorders associated with mast cell or basophil acitvity POSEIDON PHARMACEUTICALS A/S (DK) 2005-04-14 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-20050080112-A1 Compounds for use in disorders associated with mast cell or basophil acitvity CPA3, HNMT, CMA1 ALDH1A1 327/4885MAPT 1603/4885NPSR1 136/4885

“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.