SCHEMBL6438545

SCHEMBL6438545

O=C(Nc1ccc(Cl)c(Cl)c1)Nc1ccc(F)c(F)c1F

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.72
MEN1 O00255 10/20 0.67
KMT2A Q03164 10/20 0.67
MAPT P10636 8/20 0.67
LMNA P02545 4/20 0.67
HTT P42858 4/20 0.67
EPHX1 P07099 2/20 0.65
EPHX2 P34913 2/20 0.65
NPC1 O15118 5/20 0.62
ADORA3 P0DMS8 1/20 0.62
CHRM1 P11229 1/20 0.62
SLC6A2 P23975 1/20 0.62
PDE4A P27815 1/20 0.62
ADRA1A P35348 1/20 0.62
OPRM1 P35372 1/20 0.62
PDE3A Q14432 1/20 0.62
NLRP3 Q96P20 1/20 0.62
P2RY1 P47900 2/20 0.60
RAB9A P51151 4/20 0.57
POLB P06746 1/20 0.57

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
SCHEMBL6430898 0.85 KDR (0.72) CA2CA9CA1
SCHEMBL14758344 0.84 SLC2A1 (1.00) SLC2A1MEN1KMT2AMAPTLMNA
SCHEMBL2683478 0.80 EPHX1 (1.00) SLC2A1MEN1KMT2AMAPTLMNA
SCHEMBL30640703 0.80 EPHX1 (1.00) SLC2A1MEN1KMT2AMAPTLMNA
SCHEMBL28569820 0.78 MEN1 (0.71) SLC2A1MEN1KMT2AMAPTLMNA
Triclocarban SCHEMBL4978963 0.77 MEN1 (1.00) SLC2A1MEN1KMT2AMAPTLMNA
Triclocarban SCHEMBL27313500 0.77 MEN1 (1.00) SLC2A1MEN1KMT2AMAPTLMNA
Triclocarban SCHEMBL68658 0.77 MEN1 (1.00) SLC2A1MEN1KMT2AMAPTLMNA
Triclocarban SCHEMBL30479188 0.77 MEN1 (1.00) SLC2A1MEN1KMT2AMAPTLMNA
SCHEMBL31304857 0.76 KMT2A (0.72) MEN1KMT2AMAPTLMNAHTT

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 SLC2A1 3457/4885MEN1 903/4885KMT2A 1345/4885

“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.