SCHEMBL7189972

SCHEMBL7189972

COc1ccc2c(Oc3ccc(C=O)cc3)c(-c3ccc(OC)c(OC)c3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 3/20 0.43
TSHR P16473 1/20 0.43
TTR P02766 1/20 0.42
GSTP1 P09211 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41

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
SCHEMBL7190071 0.90 GSTP1 (0.39) MAPTNPC1RAB9AALDH1A1TSHR
SCHEMBL7194282 0.90 ERN1 (0.39) ALDH1A1TTRGSTP1TUBB1CYP2A6
SCHEMBL7189743 0.89 ALDH1A1 (0.49) MAPTALDH1A1GSTP1PLAUCYP2A6
SCHEMBL6050146 0.86 GSTP1 (0.43) MAPTALDH1A1TTRGSTP1CYP1A1
SCHEMBL7191254 0.85 ESR1 (0.44) MAPTALDH1A1GSTP1TUBB4ATUBB
SCHEMBL7182654 0.85 ALOX5 (0.43) MAPTALDH1A1GSTP1ABCG2CYP2A6
SCHEMBL7937022 0.85 MAPT (0.44) MAPTNPC1RAB9AALDH1A1GSTP1
SCHEMBL3120120 0.83 CYP1A2 (0.44) MAPTALDH1A1GSTP1CYP1A1CYP1B1
SCHEMBL7188354 0.82 RELA (0.42) ALDH1A1GSTP1CYP1A1CYP1B1CYP2A6
SCHEMBL1359561 0.82 ESR1 (0.47) MAPTALDH1A1GSTP1TUBB4ATUBB

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
EP-0835867-B1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods LILLY CO ELI (US) 2003-12-03 EP disclosed
US-5916916-A USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. ELI LILLY AND COMPANY (US) 1999-06-29 US disclosed
EP-0835867-A1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed