SCHEMBL5950461

SCHEMBL5950461

CCC(O)(CC)c1ccc(C(O)(CC)CC)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.46
ESR2 Q92731 6/20 0.46
HRH3 Q9Y5N1 1/20 0.44
AR P10275 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NR1H2 P55055 3/20 0.38
NR1H3 Q13133 3/20 0.38
CHRM3 P20309 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL22825393 0.89 HRH3 (0.40) ESR1ESR2HRH3ARCYP1A2
SCHEMBL1976050 0.89 TSHR (0.46) ESR1ESR2HRH3ARCYP2C9
SCHEMBL9307408 0.89 ESR1 (0.62) ESR1ESR2ARCYP1A2CYP2C9
SCHEMBL6089418 0.87 NR1H2 (0.45) HRH3CYP1A2CYP2C19NR1H2NR1H3
SCHEMBL22825399 0.87 HRH3 (0.39) ESR1ESR2HRH3ARNR1H2
SCHEMBL6092358 0.87 KCNN4 (0.45) ESR1ESR2HRH3CYP2C9CYP2C19
SCHEMBL11143362 0.87 MAPT (0.47) ESR1ESR2HRH3ARCYP1A2
SCHEMBL2967134 0.87 HRH3 (0.39) ESR1ESR2HRH3ARCYP1A2
SCHEMBL18905252 0.87 HRH3 (0.39) ESR1ESR2HRH3ARCYP1A2
SCHEMBL6037776 0.87 HRH3 (0.39) ESR1ESR2HRH3ARCYP1A2

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-7005216-B2 Photo mask RENESAS TECHNOLOGY CORP. (JP) 2006-02-28 US disclosed
US-6790564-B2 FOR USE IN PRODUCING SEMICONDUCTOR INTEGRATED CIRCUIT DEVICES; EFFICIENCY RENESAS TECHNOLOGY CORPORATION (JP) 2004-09-14 US disclosed
US-20030129505-A1 Krypton fluoride laser lithography; photoresist pattern RENESAS ELECTRONICS CORPORATION (JP) 2003-07-10 US disclosed
US-20020086222-A1 Photomask and manufacturing method of an electronic device therewith RENESAS ELECTRONICS CORPORATION (JP) 2002-07-04 US disclosed