SCHEMBL12373740

SCHEMBL12373740

CCn1c(C(C)NS(=O)(=O)c2ccc(NC(=O)N3CCOCC3)cc2)cnc1Oc1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.49
GAA P10253 1/20 0.47
BLM P54132 1/20 0.45
KMT2A Q03164 5/20 0.44
MEN1 O00255 3/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
AIMP2 Q13155 1/20 0.44
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 2/20 0.42

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
SCHEMBL12373741 0.88 ALDH1A1 (0.42) GAAKMT2AMEN1AIMP2ALDH1A1
SCHEMBL12373461 0.86 MAPT (0.50) GAAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL12373737 0.85 ALDH1A1 (0.47) GAAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL12373517 0.84 S1PR1 (0.44) KMT2AALDH1A1TSHRCYP2C19
SCHEMBL12373772 0.82 MEN1 (0.48) GAAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL4119410 0.81 CNR1 (0.47) MMP2ALDH1A1
SCHEMBL12373462 0.81 ADAMTS4 (0.43) MMP2GAAKMT2AMEN1RAB9A
SCHEMBL12373577 0.80 FFAR1 (0.47) MMP2ALDH1A1SMN1; SMN2CYP2C9CYP2C19
SCHEMBL12373499 0.80 S1PR1 (0.41) KMT2A
SCHEMBL12161511 0.80 MMP2 (0.48) MMP2GAABLMKMT2AMEN1

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 MMP2 3384/4885GAA 4428/4885BLM 4749/4885

“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.