SCHEMBL5898901

SCHEMBL5898901

Cc1c(C)c2occ(-c3ccc(F)cc3)c2c2c(-c3ccc(F)cc3)coc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
ALDH1A1 P00352 2/20 0.42
POLB P06746 2/20 0.41
GSK3B P49841 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
THRB P10828 1/20 0.37
PTGS1 P23219 2/20 0.37
PTGS2 P35354 2/20 0.37
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36

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
SCHEMBL5773283 0.80 THRB (0.53) MAPTESR1ESR2ALDH1A1SMN1; SMN2
SCHEMBL5898903 0.78 MAPT (0.57) MAPTESR1ESR2ALDH1A1GSK3B
SCHEMBL5772968 0.75 POLB (0.52) MAPTESR1ESR2ALDH1A1POLB
SCHEMBL3595149 0.69 THRB (0.47) MAPTESR1ESR2ALDH1A1GSK3B
SCHEMBL3603170 0.68 MAPT (0.38) MAPTESR1ESR2ALDH1A1SMN1; SMN2
SCHEMBL16807848 0.65 MAPK14 (0.50) MAPTALDH1A1POLBGSK3BSMN1; SMN2
SCHEMBL11704909 0.65 GSK3B (0.40) MAPTALDH1A1POLBGSK3BSMN1; SMN2
SCHEMBL10521137 0.65 ABCB1 (0.50) MAPTALDH1A1POLBGSK3BSMN1; SMN2
SCHEMBL11702360 0.63 SMN1; SMN2 (0.41) MAPTALDH1A1POLBGSK3BSMN1; SMN2
SCHEMBL21938179 0.63 ACHE (0.46) MAPTALDH1A1SMN1; SMN2NPC1RAB9A

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-6653346-B1 Amtiischemic and antiinflammatory agents GALILEO PHARMACEUTICALS, INC. 2003-11-25 US claimed
US-7078541-B2 Benzofuran derivatives GALILEO PHARMACEUTICALS, INC. (US) 2006-07-18 US disclosed
US-20040063975-A1 Benzofuran derivatives EDISON PHARMACEUTICALS, INC. 2004-04-01 US disclosed
US-6653346-B1 Amtiischemic and antiinflammatory agents GALILEO PHARMACEUTICALS, INC. 2003-11-25 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-20040063975-A1 Benzofuran derivatives NDUFAB1, AIFM1, NDUFAF1 MAPT 278/4885ESR1 2763/4885ESR2 1627/4885

“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.