SCHEMBL7517892

SCHEMBL7517892

O=C(O)COc1ccc2c(c1)CCc1sc(SC(c3ccccc3)c3ccccc3)nc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.46
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPT P10636 7/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 3/20 0.41
MEN1 O00255 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TP53 P04637 2/20 0.41
PTPN7 P35236 1/20 0.39
ADORA1 P30542 1/20 0.39
RAB9A P51151 2/20 0.39

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
SCHEMBL7526057 0.92 FBP1 (0.46) FBP1ALOX15TSHRHSD17B10MAPT
SCHEMBL7521609 0.87 FBP1 (0.44) FBP1ALOX15TSHRHSD17B10MAPT
SCHEMBL7519310 0.80 PTGIR (0.43) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL7526346 0.80 FBP1 (0.45) FBP1ALOX15TSHRHSD17B10MAPT
SCHEMBL7528931 0.79 FBP1 (0.54) FBP1ALOX15TSHRHSD17B10MAPT
SCHEMBL7524018 0.79 FBP1 (0.43) FBP1ALOX15TSHRHSD17B10MAPT
SCHEMBL7520989 0.78 PPARD (0.40) RAB9ANPC1PPARGPPARA
SCHEMBL7518394 0.78 MAPT (0.43) ALOX15TSHRHSD17B10MAPTSMN1; SMN2
SCHEMBL7518608 0.77 PTGIR (0.40) RAB9ALMNANPC1
SCHEMBL7523179 0.77 PTGIR (0.40)

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-6417213-B2 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-07-09 US disclosed
US-20020006944-A1 Tricyclic compounds, their production and use OHKAWA SHIGENORI (JP) 2002-01-17 US disclosed
US-6248766-B1 CARDIOVASCULAR DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-19 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-20020006944-A1 Tricyclic compounds, their production and use CNR1, PTGER1, PTGDR FBP1 3869/4885ALOX15 448/4885TSHR 179/4885

“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.