SCHEMBL10088907

SCHEMBL10088907

O=CC1=Cc2ccc(-c3ccccc3)cc2OC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
PTGS2 P35354 7/20 0.36
PTGS1 P23219 6/20 0.36
TRIM24 O15164 1/20 0.36
TRIM33 Q9UPN9 1/20 0.36
PTPN1 P18031 3/20 0.35
PTPN2 P17706 2/20 0.35
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
POLB P06746 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL9729620 0.88 ALOX5 (0.51) ALOX5KDM4ENPC1GAAMAPT
SCHEMBL10088938 0.87 CA12 (0.35) ALOX5KDM4ENPC1GAAMAPT
SCHEMBL10310537 0.83 PTGS1 (0.46) ALOX5KDM4ENPC1GAAMAPT
SCHEMBL10088925 0.83 CA9 (0.48) PTGS2PTGS1CA12CA9
SCHEMBL10088926 0.83 CA9 (0.43) PTGS2PTGS1CA12CA9
SCHEMBL10088470 0.81 MAOB (0.49) ALOX5NPC1RAB9A
SCHEMBL10088944 0.79 AR (0.39) PTGS2PTGS1
SCHEMBL29804937 0.79 PTGS1 (0.51) ALOX5KDM4ENPC1GAAMAPT
SCHEMBL2568148 0.79 PTGS1 (0.51) ALOX5KDM4ENPC1GAAMAPT
SCHEMBL10310542 0.78 PTGS1 (0.39) KDM4ENPC1GAAMAPTRAB9A

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-20120178735-A1 2H-CHROMENE COMPOUND AND DERIVATIVE THEREOF ASTELLAS PHARMA INC. (JP) 2012-07-12 US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 ALOX5 257/4885KDM4E 3199/4885NPC1 372/4885
US-20120178735-A1 2H-CHROMENE COMPOUND AND DERIVATIVE THEREOF S1PR1, S1PR2, S1PR4 ALOX5 377/4885KDM4E 2391/4885NPC1 271/4885

“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.