SCHEMBL10088936

SCHEMBL10088936

COc1cc(OCc2ccc(C(F)(F)F)cc2C(F)(F)F)cc2c1C=C(C=O)CO2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 12/20 0.41
FOXM1 Q08050 1/20 0.39
SRD5A1 P18405 1/20 0.37
SLC6A4 P31645 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
USP2 O75604 1/20 0.35
RAB9A P51151 1/20 0.35
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
SRD5A2 P31213 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR2 O15552 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31

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
SCHEMBL10088529 0.91 FOXM1 (0.33) ESRRAFOXM1SRD5A1NPC1RAB9A
SCHEMBL10088901 0.89 SRD5A1 (0.42) ESRRAFOXM1SRD5A1SLC6A4MAOA
SCHEMBL10088904 0.88 SRD5A1 (0.37) ESRRAFOXM1SRD5A1SLC6A4MAOA
SCHEMBL10310541 0.82 EPHX2 (0.36) FOXM1MEN1KMT2ANPC1RAB9A
SCHEMBL2326732 0.82 SRD5A1 (0.42) ESRRAFOXM1SRD5A1SLC6A4MAOA
SCHEMBL10088463 0.80 SRD5A1 (0.33) SRD5A1NPC1RAB9AMAOAMAOB
SCHEMBL10088465 0.79 SRD5A1 (0.31) SRD5A1NPC1RAB9A
SCHEMBL10310548 0.78 S1PR1 (0.44) ESRRA
SCHEMBL10088577 0.77 SLC6A4 (0.34) SLC6A4FFAR1FFAR4
SCHEMBL10088409 0.75 ROR1 (0.37) MAOB

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 ESRRA 645/4885FOXM1 693/4885SRD5A1 397/4885

“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.