SCHEMBL2500073

SCHEMBL2500073

CN1c2ccccc2S(=O)(=O)c2cc(C=Cc3ccc(-c4ccc(C=Cc5ccc6c(c5)S(=O)(=O)c5ccccc5N6C)cc4)cc3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.51
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
RXFP1 Q9HBX9 1/20 0.36
LMNA P02545 4/20 0.35
TP53 P04637 3/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
HDAC1 Q13547 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL2500070 1.00 MAOA (0.51) MAOACA12CA1CA2CA4
SCHEMBL2503731 0.84 MAOA (0.55) MAOACA12CA1CA2CA4
SCHEMBL2498560 0.83 RXFP1 (0.37) MAOARXFP1LMNATP53MAPT
SCHEMBL2498562 0.83 RXFP1 (0.37) MAOARXFP1LMNATP53MAPT
SCHEMBL25841708 0.82 MAOA (0.53) MAOACA12CA1CA2CA4
SCHEMBL2494201 0.81 MAPT (0.36) MAOARXFP1LMNATP53MAPT
SCHEMBL2494203 0.81 MAPT (0.36) MAOARXFP1LMNATP53MAPT
SCHEMBL2494216 0.78 MAOA (0.58) MAOACA12CA1CA2CA4
SCHEMBL2495208 0.77 MAOA (0.49) MAOACA12CA1CA2CA4
SCHEMBL23434707 0.73 MAOA (0.56) MAOACA12CA1CA2CA4

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-8029919-B2 Phenothiazines, S-oxides, and S,S-dioxides as well as phenoxazines as emitters for OLEDs BASF AKTIENGESELLSCHAFT (DE) 2011-10-04 US disclosed
US-20100308714-A1 Phenothiazines, S-Oxides, And S,S-Dioxides As Well As Phenoxazines As Emitters For Oleds BASF AKTIENGESELLSCHAFT (DE) 2010-12-09 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-20100308714-A1 Phenothiazines, S-Oxides, And S,S-Dioxides As Well As Phenoxazines As Emitters For Oleds PPOX, SMOX, SORD MAOA 82/4885CA12 4757/4885CA1 4877/4885

“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.