SCHEMBL10088965

SCHEMBL10088965

CC1=C(C=O)CCc2cc(OCc3cc(-c4ccccc4)c(C(F)(F)F)s3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 16/20 0.49
S1PR5 Q9H228 13/20 0.49
S1PR4 O95977 12/20 0.49
S1PR3 Q99500 10/20 0.49
MAOA P21397 3/20 0.37
MAOB P27338 3/20 0.37
PLK1 P53350 1/20 0.35

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
SCHEMBL10088584 0.88 MAOA (0.38) S1PR1S1PR5S1PR4S1PR3MAOA
SCHEMBL10310545 0.85 MAOA (0.36) S1PR1S1PR5S1PR4S1PR3MAOA
SCHEMBL1032578 0.83 S1PR4 (0.54) S1PR1S1PR5S1PR4S1PR3MAOA
SCHEMBL10088587 0.79 MAOA (0.36) S1PR1S1PR3MAOAMAOB
SCHEMBL450942 0.78 MAOB (0.56) S1PR1MAOAMAOB
SCHEMBL10310553 0.77 S1PR1 (0.51) S1PR1S1PR5S1PR4S1PR3
SCHEMBL3821170 0.77 S1PR1 (0.59) S1PR1S1PR5S1PR4S1PR3PLK1
SCHEMBL12440605 0.77 S1PR1 (0.45) S1PR1S1PR5S1PR4S1PR3
SCHEMBL10310555 0.77 S1PR1 (0.51) S1PR1S1PR5S1PR4S1PR3
SCHEMBL10310550 0.76 S1PR1 (0.50) S1PR1S1PR5S1PR4S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193378-B2 2H-chromene compound and derivative thereof ASTELLAS PHARMA INC. (JP) 2012-06-05 US disclosed
US-20110230463-A1 2H-CHROMENE COMPOUND AND DERIVATIVE THEREOF ASTELLAS PHARMA INC. (JP) 2011-09-22 US disclosed
WO-2010064707-A1 2H-CHROMENE COMPOUND AND DERIVATIVE THEREOF アステラス製薬株式会社 (JP) 2010-06-10 WO 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-20110230463-A1 2H-CHROMENE COMPOUND AND DERIVATIVE THEREOF S1PR1, S1PR2, CCR1 S1PR1 1/4885S1PR5 4/4885S1PR4 5/4885

“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.