SCHEMBL12373645

SCHEMBL12373645

CCn1c(C(C)NS(=O)(=O)Cc2cccc(Cl)c2)cnc1Oc1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
ADAMTS4 O75173 1/20 0.38
MMP13 P45452 1/20 0.38
CNR1 P21554 2/20 0.36
CNR2 P34972 1/20 0.36
P2RX3 P56373 5/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NR3C1 P04150 1/20 0.35
GRM5 P41594 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
S1PR1 P21453 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34

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
SCHEMBL12373518 0.90 ALDH1A1 (0.45) MEN1KMT2ACNR1CNR2P2RX3
SCHEMBL12373626 0.88 HTT (0.37) P2RX3MAPT
SCHEMBL12373593 0.85 S1PR1 (0.46) KMT2AALDH1A1NR3C1GAAS1PR1
SCHEMBL12373699 0.84 P2RX3 (0.39) MEN1LMNAKMT2AADAMTS4MMP13
SCHEMBL12373491 0.84 PTGS1 (0.36) MEN1KMT2AMMP13CNR1P2RX3
SCHEMBL12373488 0.81 S1PR1 (0.39) LMNAP2RX3NR3C1S1PR1
SCHEMBL12373549 0.81 S1PR1 (0.44) KMT2AS1PR1
SCHEMBL12373629 0.80 MEN1 (0.37) MEN1KMT2AMMP13P2RX3ALDH1A1
SCHEMBL12373581 0.80 S1PR1 (0.41) CNR2NR3C1S1PR1
SCHEMBL12373486 0.80 S1PR1 (0.41) MEN1LMNAKMT2AALDH1A1NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7994204-B2 Binding inhibitor of sphingosine-1-phosphate TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-08-09 US disclosed
US-7994204-B2 Binding inhibitor of sphingosine-1-phosphate TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-08-09 US disclosed
US-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-07-16 US disclosed
US-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-07-16 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-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE S1PR1, S1PR3, S1PR2 MEN1 1204/4885LMNA 3437/4885KMT2A 3906/4885

“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.